Opened 11 hours ago

#20008 new defect

ChimeraX bug report submission

Reported by: apadavannil@… Owned by:
Priority: normal Milestone:
Component: Unassigned Version:
Keywords: Cc:
Blocked By: Blocking:
Notify when closed: Platform:
Project:

Description

The following bug report has been submitted:
Platform:        macOS-14.5-arm64-arm-64bit
ChimeraX Version: 1.10 (2025-06-26 08:57:52 UTC)
Description
Replace this text with list of actions that caused this problem to occur

Log:
UCSF ChimeraX version: 1.10 (2025-06-26)  
© 2016-2025 Regents of the University of California. All rights reserved.  

> open /Users/apadavan/Documents/Daphnia_Model_Building/Daphnia-
> Figures/Daphnia-Prep-2-021726.cxs

Opened composite_map.ccp4 as #2, grid size 245,254,396, pixel 0.88,0.88,0.88,
shown at level 2.78, step 1, values float32  
Opened cryosparc_P33_J165_005_volume_map_sharp.mrc as #3, grid size
600,600,600, pixel 0.88, shown at level 0.15, step 1, values float32  
Opened cryosparc_P33_J122_004_volume_map_sharp.mrc as #4, grid size
600,600,600, pixel 0.88, shown at level 0.578, step 1, values float32  
Log from Thu Feb 19 15:22:31 2026UCSF ChimeraX version: 1.10 (2025-06-26)  
© 2016-2025 Regents of the University of California. All rights reserved.  

> open /Users/apadavan/Documents/Daphnia_Model_Building/Daphnia-
> Figures/Daphnia-Model-Map.cxs

Opened composite_map.ccp4 as #2, grid size 245,254,396, pixel 0.88,0.88,0.88,
shown at level 2.78, step 1, values float32  
Log from Tue Dec 9 17:07:25 2025 Startup Messages  
---  
note | available bundle cache has not been initialized yet  
  
UCSF ChimeraX version: 1.9 (2024-12-11)  
© 2016-2024 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open
> /Users/apadavan/Documents/Daphnia_Model_Building/CombineFocusedMaps_15/composite_map.ccp4

Opened composite_map.ccp4 as #1, grid size 245,254,396, pixel 0.88,0.88,0.88,
shown at level 5.3, step 2, values float32  

> volume #1 step 1

> volume #1 level 2.283

> volume #1 level 1.989

[Repeated 1 time(s)]

> ui tool show "Hide Dust"

> surface dust #1 size 5.28

> set bgColor white

> lighting soft

> surface dust #1 size 6

[Repeated 2 time(s)]

> open
> /Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_31/pdb_extract_out_coot-39_real_space_refined_031.cif

Summary of feedback from opening
/Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_31/pdb_extract_out_coot-39_real_space_refined_031.cif  
---  
warnings | Skipping chem_comp category: Missing column 'type' on line 6347  
Missing entity information. Treating each chain as a separate entity.  
Invalid residue range for struct_conf "1": invalid chain "3S", on line 226  
Invalid residue range for struct_conf "2": invalid chain "3S", on line 227  
Invalid residue range for struct_conf "3": invalid chain "3S", on line 228  
Invalid residue range for struct_conf "4": invalid chain "3H", on line 229  
Invalid residue range for struct_conf "5": invalid chain "3H", on line 230  
315 messages similar to the above omitted  
Bad residue range for struct_conf "329" on line 554  
Bad residue range for struct_conf "330" on line 555  
Bad residue range for struct_conf "331" on line 556  
Bad residue range for struct_conf "332" on line 557  
Bad residue range for struct_conf "333" on line 558  
9 messages similar to the above omitted  
Invalid residue range for struct_conf "343": invalid entity "AM", on line 568  
Invalid residue range for struct_conf "344": invalid entity "AM", on line 569  
Invalid residue range for struct_conf "345": invalid entity "AM", on line 570  
Invalid residue range for struct_conf "346": invalid entity "AM", on line 571  
Invalid residue range for struct_conf "347": invalid entity "AM", on line 572  
Bad residue range for struct_conf "350" on line 575  
Bad residue range for struct_conf "351" on line 576  
Bad residue range for struct_conf "353" on line 578  
Bad residue range for struct_conf "354" on line 579  
Bad residue range for struct_conf "355" on line 580  
Invalid residue range for struct_conf "356": invalid chain "B2", on line 581  
Invalid residue range for struct_conf "357": invalid chain "B2", on line 582  
Invalid residue range for struct_conf "358": invalid chain "B2", on line 583  
Invalid residue range for struct_conf "359": invalid chain "B3", on line 584  
Invalid residue range for struct_conf "360": invalid chain "B3", on line 585  
34 messages similar to the above omitted  
Bad residue range for struct_conf "401" on line 626  
Bad residue range for struct_conf "402" on line 627  
Bad residue range for struct_conf "403" on line 628  
Bad residue range for struct_conf "404" on line 629  
Invalid residue range for struct_conf "405": invalid chain "C2", on line 630  
Invalid residue range for struct_conf "406": invalid chain "C2", on line 631  
Invalid residue range for struct_conf "407": invalid chain "C2", on line 632  
Invalid residue range for struct_conf "408": invalid chain "C2", on line 633  
Invalid residue range for struct_conf "409": invalid chain "S1", on line 634  
115 messages similar to the above omitted  
Invalid sheet range for struct_sheet_range "1 1": invalid chain "3A", on line
6101  
Invalid sheet range for struct_sheet_range "1 2": invalid chain "3A", on line
6102  
Invalid sheet range for struct_sheet_range "2 1": invalid chain "3A", on line
6103  
Invalid sheet range for struct_sheet_range "2 2": invalid chain "3A", on line
6104  
Invalid sheet range for struct_sheet_range "2 3": invalid chain "3A", on line
6105  
130 messages similar to the above omitted  
Missing or incomplete sequence information. Inferred polymer connectivity.  
Skipping chem_comp category: Missing column 'type' on line 111617  
Skipping chem_comp category: Missing column 'type' on line 112100  
Skipping chem_comp category: Missing column 'type' on line 112123  
Skipping chem_comp category: Missing column 'type' on line 112744  
Skipping chem_comp category: Missing column 'type' on line 112767  
7 messages similar to the above omitted  
note | Fetching CCD CUA from https://files.wwpdb.org/pub/pdb/refdata/chem_comp/A/CUA/CUA.cif  
  
Chain information for pdb_extract_out_coot-39_real_space_refined_031.cif #2  
---  
Chain | Description  
1 | No description available  
2 | No description available  
3 | No description available  
3A 3L | No description available  
3B | No description available  
3C | No description available  
3D | No description available  
3E | No description available  
3F | No description available  
3G | No description available  
3H 3S | No description available  
3J | No description available  
3M | No description available  
3N | No description available  
3O | No description available  
3Q | No description available  
3R | No description available  
3T | No description available  
3U | No description available  
4 | No description available  
4A | No description available  
4B | No description available  
4C | No description available  
4D | No description available  
4E | No description available  
4F | No description available  
4H | No description available  
4I | No description available  
4J | No description available  
4K | No description available  
4L | No description available  
4M | No description available  
4N | No description available  
5 | No description available  
6 | No description available  
A1 | No description available  
A2 | No description available  
A3 | No description available  
A5 | No description available  
A6 | No description available  
A7 | No description available  
A8 | No description available  
A9 | No description available  
AB | No description available  
AC | No description available  
AL | No description available  
AM | No description available  
AN | No description available  
AO | No description available  
B1 | No description available  
B2 | No description available  
B3 | No description available  
B4 | No description available  
B5 | No description available  
B6 | No description available  
B7 | No description available  
B8 | No description available  
B9 | No description available  
BL | No description available  
BM | No description available  
C2 | No description available  
S1 | No description available  
S2 | No description available  
S3 | No description available  
S4 | No description available  
S5 | No description available  
S6 | No description available  
S7 | No description available  
S8 | No description available  
V1 | No description available  
V2 | No description available  
  

> hide atoms

> show cartoons

> hide #!1 models

> show #!1 models

> open
> /Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_31/pdb_extract_out_coot-39_real_space_refined_031.pdb

Summary of feedback from opening
/Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_31/pdb_extract_out_coot-39_real_space_refined_031.pdb  
---  
warnings | Ignored bad PDB record found on line 864  
SSBOND 1 CYS 3S 20 CYS 3S 64  
  
Ignored bad PDB record found on line 865  
SSBOND 2 CYS 3S 26 CYS 3S 60  
  
Ignored bad PDB record found on line 866  
SSBOND 3 CYS 3S 36 CYS 3S 50  
  
Ignored bad PDB record found on line 867  
SSBOND 4 CYS 3H 20 CYS 3H 64  
  
Ignored bad PDB record found on line 868  
SSBOND 5 CYS 3H 26 CYS 3H 60  
  
7 messages similar to the above omitted  
  
Chain information for pdb_extract_out_coot-39_real_space_refined_031.pdb #3  
---  
Chain | Description  
1 | No description available  
2 | No description available  
3 | No description available  
3A 3L | No description available  
3B | No description available  
3C | No description available  
3D | No description available  
3E | No description available  
3F | No description available  
3G | No description available  
3H 3S | No description available  
3J | No description available  
3M | No description available  
3N | No description available  
3O | No description available  
3Q | No description available  
3R | No description available  
3T | No description available  
3U | No description available  
4 | No description available  
4A | No description available  
4B | No description available  
4C | No description available  
4D | No description available  
4E | No description available  
4F | No description available  
4H | No description available  
4I | No description available  
4J | No description available  
4K | No description available  
4L | No description available  
4M | No description available  
4N | No description available  
5 | No description available  
6 | No description available  
A1 | No description available  
A2 | No description available  
A3 | No description available  
A5 | No description available  
A6 | No description available  
A7 | No description available  
A8 | No description available  
A9 | No description available  
AB | No description available  
AC | No description available  
AL | No description available  
AM | No description available  
AN | No description available  
AO | No description available  
B1 | No description available  
B2 | No description available  
B3 | No description available  
B4 | No description available  
B5 | No description available  
B6 | No description available  
B7 | No description available  
B8 | No description available  
B9 | No description available  
BL | No description available  
BM | No description available  
C2 | No description available  
S1 | No description available  
S2 | No description available  
S3 | No description available  
S4 | No description available  
S5 | No description available  
S6 | No description available  
S7 | No description available  
S8 | No description available  
V1 | No description available  
V2 | No description available  
  

> hide #!2 models

> hide #!3 atoms

> show #!3 cartoons

> hide #!1 models

> graphics silhouettes true

> show #!1 models

> close #2

> close #3

> close #1

> open
> /Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_31/pdb_extract_out_coot-39_real_space_refined_031.pdb

Summary of feedback from opening
/Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_31/pdb_extract_out_coot-39_real_space_refined_031.pdb  
---  
warnings | Ignored bad PDB record found on line 864  
SSBOND 1 CYS 3S 20 CYS 3S 64  
  
Ignored bad PDB record found on line 865  
SSBOND 2 CYS 3S 26 CYS 3S 60  
  
Ignored bad PDB record found on line 866  
SSBOND 3 CYS 3S 36 CYS 3S 50  
  
Ignored bad PDB record found on line 867  
SSBOND 4 CYS 3H 20 CYS 3H 64  
  
Ignored bad PDB record found on line 868  
SSBOND 5 CYS 3H 26 CYS 3H 60  
  
7 messages similar to the above omitted  
  
Chain information for pdb_extract_out_coot-39_real_space_refined_031.pdb #1  
---  
Chain | Description  
1 | No description available  
2 | No description available  
3 | No description available  
3A 3L | No description available  
3B | No description available  
3C | No description available  
3D | No description available  
3E | No description available  
3F | No description available  
3G | No description available  
3H 3S | No description available  
3J | No description available  
3M | No description available  
3N | No description available  
3O | No description available  
3Q | No description available  
3R | No description available  
3T | No description available  
3U | No description available  
4 | No description available  
4A | No description available  
4B | No description available  
4C | No description available  
4D | No description available  
4E | No description available  
4F | No description available  
4H | No description available  
4I | No description available  
4J | No description available  
4K | No description available  
4L | No description available  
4M | No description available  
4N | No description available  
5 | No description available  
6 | No description available  
A1 | No description available  
A2 | No description available  
A3 | No description available  
A5 | No description available  
A6 | No description available  
A7 | No description available  
A8 | No description available  
A9 | No description available  
AB | No description available  
AC | No description available  
AL | No description available  
AM | No description available  
AN | No description available  
AO | No description available  
B1 | No description available  
B2 | No description available  
B3 | No description available  
B4 | No description available  
B5 | No description available  
B6 | No description available  
B7 | No description available  
B8 | No description available  
B9 | No description available  
BL | No description available  
BM | No description available  
C2 | No description available  
S1 | No description available  
S2 | No description available  
S3 | No description available  
S4 | No description available  
S5 | No description available  
S6 | No description available  
S7 | No description available  
S8 | No description available  
V1 | No description available  
V2 | No description available  
  

> hide atoms

> show cartoons

> select /3A:34-475

3419 atoms, 3483 bonds, 442 residues, 1 model selected  

> select /3L:34-475

3419 atoms, 3483 bonds, 442 residues, 1 model selected  

> select /3B:32-439

2974 atoms, 3013 bonds, 408 residues, 1 model selected  

> select /3B:32-439

2974 atoms, 3013 bonds, 408 residues, 1 model selected  

> select /3M:31-439

2980 atoms, 3019 bonds, 409 residues, 1 model selected  

> select /3C:8-377

2982 atoms, 3090 bonds, 370 residues, 1 model selected  

> select /3N:9-377

2972 atoms, 3079 bonds, 369 residues, 1 model selected  

> select /3D:68-304

1888 atoms, 1945 bonds, 237 residues, 1 model selected  

> select /3O:69-303

1871 atoms, 1928 bonds, 235 residues, 1 model selected  

> select /3D:68-304

1888 atoms, 1945 bonds, 237 residues, 1 model selected  

> select /3O:69-303

1871 atoms, 1928 bonds, 235 residues, 1 model selected  

> select /3E:79-148

502 atoms, 510 bonds, 70 residues, 1 model selected  

> select /3F:9-108

853 atoms, 872 bonds, 100 residues, 1 model selected  

> select /3Q:13-110

841 atoms, 860 bonds, 98 residues, 1 model selected  

> select /3G:4-74

587 atoms, 602 bonds, 71 residues, 1 model selected  

> select /3R:4-73

578 atoms, 593 bonds, 70 residues, 1 model selected  

> select /3H:9-74

518 atoms, 525 bonds, 66 residues, 1 model selected  

> select /3H:9-74

518 atoms, 525 bonds, 66 residues, 1 model selected  

> select /3H:9-74

518 atoms, 525 bonds, 66 residues, 1 model selected  

> select /3H:9-74

518 atoms, 525 bonds, 66 residues, 1 model selected  

> select /3H:9-74

518 atoms, 525 bonds, 66 residues, 1 model selected  

> select /3S:9-74

518 atoms, 525 bonds, 66 residues, 1 model selected  

> select /3H:9-74

518 atoms, 525 bonds, 66 residues, 1 model selected  

> select /3S:9-74

518 atoms, 525 bonds, 66 residues, 1 model selected  

> select /3J:5-57

434 atoms, 443 bonds, 53 residues, 1 model selected  

> select /3U:25-59

294 atoms, 302 bonds, 35 residues, 1 model selected  

> color #1/V1 #DC050C

> color #1/V2 #E8601C

> color #1/S1 #F1932D

> color #1/S2 #F6C141

> color #1/S3 #F7F056

> color #1/S7 #CAE0AB

> color #1/S8 #90C987

> color #1/1 #7BAFDE

> color #1/2 #D1BBD7

> color #1/3 #4EB265

> color #1/4 #AE76A3

> color #1/4L #1965B0

> color #1/5 #882E72

> color #1/6 #52FFD2

> color #1/A1 #B8221E

> color #1/A2 #2E8B57

> color #1/A3 #69B190

> color #1/A5 #95211b

> color #1/A6 #DF4828

> color #1/A7 #4D8AC6

> color #1/A8 #FF99FF

> color #1/A9 #6F4C9B

> color #1/AL #59A5A9

> color #1/AM #FEDA8B

> color #1/AN #D1B541

> color #1/AO #BEBC48

> color #1/AB #B58FC2

> color #1/AC #B58FC2

> color #1/B1 #DA2222

> color #1/B2 #E78C35

> color #1/B3 #77B77D

> color #1/B4 #D1B541

> color #1/B5 #4A7BB7

> color #1/B6 #D1B541

> color #1/B7 #DDAA3C

> color #1/B8 #E67932

> color #1/B9 #E49C39

> color #1/BL #95211B

> color #1/BM #E4632D

> color #1/C2 #8CBC68

> color #1/S4 #8C4E99

> color #1/S5 #60AB9E

> color #1/S6 #721E17

> color #1/3A /3L #7BAFDE

> color #1/3B /3M #1965B0

> color #1/3C /3N #AE76A3

> color #1/3D /3O #F1932D

> color #1/3E /3P #285e34

> color #1/3F /3Q #5289C7

> color #1/3G /3R #90C987

> color #1/3H /3S #F7F056

> color #1/3J /3U #882E72

> color #1/3K /3V #F6C141

> select clear

> select
> ::name="ATPA"::name="CU"::name="CUA4"::name="FESS"::name="FESV"::name="FMN"::name="HEA"::name="HEC3"::name="HEM"::name="HEM3"::name="MG4"::name="NDPA"::name="SF4"::name="SF4S"::name="SF4V"::name="ZN4"::name="ZNS"

550 atoms, 528 bonds, 137 pseudobonds, 24 residues, 2 models selected  

> show sel atoms

> style sel stick

Changed 550 atom styles  

> select clear

> select
> ::name="ATPA"::name="CU"::name="CUA4"::name="FESS"::name="FESV"::name="FMN"::name="HEA"::name="HEC3"::name="HEM"::name="HEM3"::name="MG4"::name="NDPA"::name="SF4"::name="SF4S"::name="SF4V"::name="ZN4"::name="ZNS"

550 atoms, 528 bonds, 137 pseudobonds, 24 residues, 2 models selected  

> color sel byhetero

> select clear

> cartoon style modeHelix tube sides 20

> lighting soft

> graphics silhouettes false

> graphics silhouettes true

> cartoon style xsection oval modeHelix default

> color #1/4A #6B8E23

> color #1/4B #D2691E

> color #1/4C #663399

> color #1/4D #8B0000

> color #1/4E #006400

> color #1/4F #191970

> color #1/4H #FFA500

> color #1/4I #FF4500

> color #1/4J #2E8B57

> color #1/4K #1E90FF

> color #1/4M #B22222

> color #1/4N #F4A460

> select
> ::name="ATPA"::name="CU"::name="CUA4"::name="FESS"::name="FESV"::name="FMN"::name="HEA"::name="HEC3"::name="HEM"::name="HEM3"::name="MG4"::name="NDPA"::name="SF4"::name="SF4S"::name="SF4V"::name="ZN4"::name="ZNS"

550 atoms, 528 bonds, 137 pseudobonds, 24 residues, 2 models selected  

> color sel byhetero

> select clear

> open
> /Users/apadavan/Documents/Daphnia_Model_Building/CombineFocusedMaps_15/composite_map.ccp4

Opened composite_map.ccp4 as #2, grid size 245,254,396, pixel 0.88,0.88,0.88,
shown at level 5.3, step 2, values float32  

> volume #2 step 1

> volume #2 level 2.776

> ui tool show "Hide Dust"

> surface dust #2 size 6.5

> select add #1

104746 atoms, 107359 bonds, 220 pseudobonds, 13220 residues, 3 models selected  

> color zone #2 near sel range 4.0

Expected a keyword  

> color zone #2 near sel distance 3.5

> select clear

> transparency 70

> select
> ::name="ATPA"::name="CU"::name="CUA4"::name="FESS"::name="FESV"::name="FMN"::name="HEA"::name="HEC3"::name="HEM"::name="HEM3"::name="MG4"::name="NDPA"::name="SF4"::name="SF4S"::name="SF4V"::name="ZN4"::name="ZNS"

550 atoms, 528 bonds, 137 pseudobonds, 24 residues, 2 models selected  

> show sel atoms

> style sel sphere

Changed 550 atom styles  

> style sel stick

Changed 550 atom styles  

> style sel ball

Changed 550 atom styles  

> style sel stick

Changed 550 atom styles  

> select clear

> save /Users/apadavan/Documents/Daphnia_Model_Building/Daphnia-
> Figures/Daphnia-Model-Map.cxs

——— End of log from Tue Dec 9 17:07:25 2025 ———

> view name session-start

opened ChimeraX session  

> hide #!2 models

> show #!2 models

> open /Users/apadavan/Documents/Daphnia_Model_Building/Daphnia-
> Figures/cryosparc_P33_J165_005_volume_map_sharp.mrc

Opened cryosparc_P33_J165_005_volume_map_sharp.mrc as #3, grid size
600,600,600, pixel 0.88, shown at level 0.0808, step 4, values float32  

> volume #3 step 1

> volume #3 level 0.1918

> hide #!2 models

> select add #1

104746 atoms, 107359 bonds, 220 pseudobonds, 13220 residues, 3 models selected  

> ui mousemode right "translate selected models"

> view matrix models #1,1,0,0,16.091,0,1,0,22.583,0,0,1,7.8558

> view matrix models #1,1,0,0,124.95,0,1,0,177.39,0,0,1,89.896

> view matrix models #1,1,0,0,141.31,0,1,0,162.66,0,0,1,76.355

> view matrix models #1,1,0,0,147.69,0,1,0,148.14,0,0,1,66.945

> view matrix models #1,1,0,0,148.7,0,1,0,142.2,0,0,1,73.846

> view matrix models #1,1,0,0,149.41,0,1,0,140.58,0,0,1,76.465

> view matrix models #1,1,0,0,157.4,0,1,0,147.58,0,0,1,84.098

> view matrix models #1,1,0,0,154.54,0,1,0,143.77,0,0,1,82.488

> view matrix models #1,1,0,0,158.41,0,1,0,141.03,0,0,1,79.143

> view matrix models #1,1,0,0,163.01,0,1,0,139.13,0,0,1,76.814

> view matrix models #1,1,0,0,161.39,0,1,0,138.24,0,0,1,75.753

> view matrix models #1,1,0,0,162.59,0,1,0,134.37,0,0,1,80.332

> view matrix models #1,1,0,0,161.96,0,1,0,135.51,0,0,1,79.774

> select subtract #1

Nothing selected  

> fitmap #1 inMap #3

Fit molecule pdb_extract_out_coot-39_real_space_refined_031.pdb (#1) to map
cryosparc_P33_J165_005_volume_map_sharp.mrc (#3) using 104746 atoms  
average map value = 0.1295, steps = 316  
shifted from previous position = 10.5  
rotated from previous position = 12 degrees  
atoms outside contour = 85110, contour level = 0.19182  
  
Position of pdb_extract_out_coot-39_real_space_refined_031.pdb (#1) relative
to cryosparc_P33_J165_005_volume_map_sharp.mrc (#3) coordinates:  
Matrix rotation and translation  
0.99783126 0.05072189 -0.04195324 167.29407168  
-0.05799802 0.97889733 -0.19594958 185.36709852  
0.03112898 0.19795782 0.97971613 63.89752363  
Axis 0.94890157 -0.17605111 -0.26190038  
Axis point 0.00000000 -356.55446853 1082.66241183  
Rotation angle (degrees) 11.97938102  
Shift along axis 109.37673924  
  

> volume #3 level 0.1668

> ui tool show "Hide Dust"

> surface dust #3 size 6.5

> show #!2 models

> select add #2

2 models selected  

> view matrix models #2,1,0,0,124.17,0,1,0,148.6,0,0,1,91.335

> view matrix models #2,1,0,0,155.21,0,1,0,140.43,0,0,1,81.14

> view matrix models #2,1,0,0,158.25,0,1,0,140.84,0,0,1,76.691

> view matrix models #2,1,0,0,158.1,0,1,0,140.76,0,0,1,76.806

> select subtract #2

Nothing selected  

> select add #2

2 models selected  

> fitmap #2 inMap #3

Fit map composite_map.ccp4 in map cryosparc_P33_J165_005_volume_map_sharp.mrc
using 698479 points  
correlation = 0.7858, correlation about mean = 0.2066, overlap = 5.03e+05  
steps = 288, shift = 12.5, angle = 12 degrees  
  
Position of composite_map.ccp4 (#2) relative to
cryosparc_P33_J165_005_volume_map_sharp.mrc (#3) coordinates:  
Matrix rotation and translation  
0.99782067 0.05082425 -0.04208085 167.32297178  
-0.05811431 0.97894953 -0.19565413 185.28902968  
0.03125106 0.19767324 0.97976970 63.91812864  
Axis 0.94852997 -0.17684382 -0.26271116  
Axis point 0.00000000 -357.46360931 1084.14064994  
Rotation angle (degrees) 11.96623566  
Shift along axis 109.15162885  
  

> select subtract #2

Nothing selected  

> hide #!1 models

> show #!1 models

> hide #!2 models

> hide cartoons #1/V1

Expected ',' or a keyword  

> select #1/A1

557 atoms, 571 bonds, 69 residues, 1 model selected  

> select #1/3A-3K

14200 atoms, 14529 bonds, 6 pseudobonds, 1818 residues, 2 models selected  

> hide #!3 models

> hide ~ sel cartoons

> select clear

> show #1//3A

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> /3B

Unknown command: /3B  

> /3C

Unknown command: /3C  

> /3D

Unknown command: /3D  

> /3E

Unknown command: /3E  

> /3F

Unknown command: /3F  

> /3G

Unknown command: /3G  

> /3H

Unknown command: /3H  

> /3J

Unknown command: /3J  

> /3K /3L

Unknown command: /3K /3L  

> /3M

Unknown command: /3M  

> /3N

Unknown command: /3N  

> /3O

Unknown command: /3O  

> /3P

Unknown command: /3P  

> /3Q

Unknown command: /3Q  

> /3R

Unknown command: /3R  

> /3S

Unknown command: /3S  

> /3U

Unknown command: /3U  

> /3V cartoon

Unknown command: /3V cartoon  

> show #1 cartoons

> select #1/3A-3V

28006 atoms, 28653 bonds, 12 pseudobonds, 3601 residues, 2 models selected  

> hide ~ sel cartoons

> select add #1

104746 atoms, 107359 bonds, 220 pseudobonds, 13220 residues, 3 models selected  

> select subtract #1

Nothing selected  

> hide atoms

> show #!2 models

> hide #!2 models

> show #!3 models

> volume #3 level 0.1418

> open /Users/apadavan/Downloads/cryosparc_P33_J122_004_volume_map_sharp.mrc

Opened cryosparc_P33_J122_004_volume_map_sharp.mrc as #4, grid size
600,600,600, pixel 0.88, shown at level 0.258, step 4, values float32  

> volume #4 step 1

> volume #4 level 0.5777

> select add #4

2 models selected  

> view matrix models #4,1,0,0,-6.2618,0,1,0,-11.237,0,0,1,-3.7229

> select subtract #4

Nothing selected  

> select add #4

2 models selected  

> select clear

> fitmap #4 inMap #3

Fit map cryosparc_P33_J122_004_volume_map_sharp.mrc in map
cryosparc_P33_J165_005_volume_map_sharp.mrc using 207947 points  
correlation = 0.969, correlation about mean = 0.7743, overlap = 5.975e+04  
steps = 308, shift = 5.98, angle = 11.8 degrees  
  
Position of cryosparc_P33_J122_004_volume_map_sharp.mrc (#4) relative to
cryosparc_P33_J165_005_volume_map_sharp.mrc (#3) coordinates:  
Matrix rotation and translation  
0.99794632 0.05215311 -0.03719125 -6.65985490  
-0.05838718 0.97940527 -0.19327767 71.15707486  
0.02634528 0.19505223 0.98043896 -51.00612266  
Axis 0.95010058 -0.15545054 -0.27045149  
Axis point 0.00000000 299.91005585 333.31206755  
Rotation angle (degrees) 11.79218406  
Shift along axis -3.59425542  
  

> surface dust #3 size 6.5

[Repeated 1 time(s)]

> surface dust #4 size 6.5

> hide #!3 models

> volume #4 color #b2ffff47

> graphics silhouettes false

> graphics silhouettes true

> volume #4 color #b2ffff4c

> volume #3 color #ffffb257

> volume #3 color #ffffb2

> volume #3 color #ffffb263

> open
> /Users/apadavan/Documents/Paramecium_Model_Building/CICIII2CIV/7TGH_Aligned.pdb

Summary of feedback from opening
/Users/apadavan/Documents/Paramecium_Model_Building/CICIII2CIV/7TGH_Aligned.pdb  
---  
warnings | Cannot find LINK/SSBOND residue ZN (101 )  
Cannot find LINK/SSBOND residue ZN (101 )  
Cannot find LINK/SSBOND residue ZN (402 )  
Cannot find LINK/SSBOND residue ZN (402 )  
Cannot find LINK/SSBOND residue ZN (201 )  
3 messages similar to the above omitted  
  
Chain information for 7TGH_Aligned.pdb #5  
---  
Chain | Description  
1 | No description available  
1B | No description available  
2 | No description available  
2B | No description available  
3 | No description available  
3A 3a | No description available  
3B 3b | No description available  
3C 3c | No description available  
3D 3d | No description available  
3E 3e | No description available  
3F 3f | No description available  
3G 3g | No description available  
3H 3h | No description available  
3I 3i | No description available  
3J 3j | No description available  
3M | No description available  
3l | No description available  
3m | No description available  
4 | No description available  
4L | No description available  
5 | No description available  
5B | No description available  
6 | No description available  
A1 | No description available  
A2 | No description available  
A3 | No description available  
A5 | No description available  
A6 | No description available  
A7 | No description available  
A8 | No description available  
A9 | No description available  
AB | No description available  
AC | No description available  
AL | No description available  
AM | No description available  
AN | No description available  
B2 | No description available  
B3 | No description available  
B4 | No description available  
B6 | No description available  
B7 | No description available  
B8 | No description available  
B9 | No description available  
BL | No description available  
BM | No description available  
C | No description available  
C1 | No description available  
C2 | No description available  
C3 | No description available  
C4 | No description available  
FX | No description available  
J1 | No description available  
P1 | No description available  
P2 | No description available  
R | No description available  
S1 | No description available  
S2 | No description available  
S3 | No description available  
S4 | No description available  
S5 | No description available  
S6 | No description available  
S7 | No description available  
S8 | No description available  
T1 | No description available  
T2 | No description available  
T3 | No description available  
T4 | No description available  
T5 | No description available  
T6 | No description available  
T7 | No description available  
T8 | No description available  
T9 | No description available  
TA | No description available  
TB | No description available  
TC | No description available  
TD | No description available  
TE | No description available  
TX | No description available  
V1 | No description available  
V2 | No description available  
X1 | No description available  
  

> hide atoms

> show cartoons

> select #5/3A-3M /3a-3m

42334 atoms, 43475 bonds, 42 pseudobonds, 5084 residues, 3 models selected  

> select add #5

153366 atoms, 157249 bonds, 98 pseudobonds, 18397 residues, 3 models selected  

> select clear

> select add #5

153366 atoms, 157249 bonds, 98 pseudobonds, 18397 residues, 3 models selected  

> view matrix models #5,1,0,0,-73.441,0,1,0,15.978,0,0,1,-145.34

> view matrix models #5,1,0,0,-146.51,0,1,0,31.91,0,0,1,-302.44

> view matrix models #5,1,0,0,-138.21,0,1,0,40.197,0,0,1,-315.93

> view matrix models #5,1,0,0,-124.37,0,1,0,45.717,0,0,1,-348.55

> view matrix models #5,1,0,0,-224.94,0,1,0,-155.95,0,0,1,-308.83

> ui mousemode right "rotate selected models"

> view matrix models
> #5,0.96481,-0.25472,0.065348,-155.06,0.25786,0.96512,-0.045191,-238.14,-0.051558,0.060451,0.99684,-304.48

> view matrix models
> #5,0.74972,-0.63276,0.19374,6.6784,0.65585,0.74951,-0.090037,-322.02,-0.088236,0.19457,0.97691,-323.64

> view matrix models
> #5,0.56772,-0.468,0.67726,-224.58,0.34604,0.88214,0.3195,-444.04,-0.74696,0.052975,0.66275,195.32

> view matrix models
> #5,0.46013,-0.43901,0.77172,-235.58,0.21815,0.89846,0.38104,-423.77,-0.86063,-0.0069815,0.50918,350.15

> view matrix models
> #5,0.84106,-0.51123,0.17683,-68.482,0.54078,0.80269,-0.25148,-201.69,-0.013373,0.30713,0.95157,-383.63

> ui mousemode right "translate selected models"

> view matrix models
> #5,0.84106,-0.51123,0.17683,-66.919,0.54078,0.80269,-0.25148,-123.19,-0.013373,0.30713,0.95157,-363.46

> select subtract #5

Nothing selected  

> mmaker #5 to #1

Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker pdb_extract_out_coot-39_real_space_refined_031.pdb, chain S1 (#1)
with 7TGH_Aligned.pdb, chain S1 (#5), sequence alignment score = 1969.3  
RMSD between 546 pruned atom pairs is 1.139 angstroms; (across all 679 pairs:
2.757)  
  

> select #5/3A-3M /3a-3m

42334 atoms, 43475 bonds, 42 pseudobonds, 5084 residues, 3 models selected  

> mmaker sel to #1

Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker pdb_extract_out_coot-39_real_space_refined_031.pdb, chain 3A (#1)
with 7TGH_Aligned.pdb, chain 3b (#5), sequence alignment score = 921.5  
RMSD between 338 pruned atom pairs is 1.128 angstroms; (across all 440 pairs:
2.760)  
  

> select add #5

153366 atoms, 157249 bonds, 98 pseudobonds, 18397 residues, 3 models selected  

> select subtract #5

Nothing selected  

> select clear

> select #1/3A-3V #5/3A-3M /3a-3m

70340 atoms, 72128 bonds, 54 pseudobonds, 8685 residues, 5 models selected  

> hide ~sel cartoons

> select clear

> volume #3 color #ffffb2fa

> hide #!1 models

> hide #!3 models

> show #!1 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> mmaker #5/3A to #1/3M

Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker pdb_extract_out_coot-39_real_space_refined_031.pdb, chain 3M (#1)
with 7TGH_Aligned.pdb, chain 3A (#5), sequence alignment score = 546.2  
RMSD between 163 pruned atom pairs is 1.154 angstroms; (across all 391 pairs:
6.309)  
  

> show #!3 models

> hide #!3 models

> show #!3 models

> hide #!3 models

> hide #!5 models

> show #!4 models

> hide #!4 models

> show #!4 models

> open "/Users/apadavan/Desktop/Mouse_Data_Processing /MouseSC-XL-
> Refinement/RealSpaceRefine_158/pdb_extract_25225_aligned-to-153-Comp-
> Map_real_space_refined_154_real_space_refined_156-coot-1_real_space_refined_157-coot6_real_space_refined_158.pdb"

Summary of feedback from opening /Users/apadavan/Desktop/Mouse_Data_Processing
/MouseSC-XL-Refinement/RealSpaceRefine_158/pdb_extract_25225_aligned-
to-153-Comp-
Map_real_space_refined_154_real_space_refined_156-coot-1_real_space_refined_157-coot6_real_space_refined_158.pdb  
---  
warnings | Ignored bad PDB record found on line 300  
SSBOND 1 CYS A8 46 CYS A8 56  
  
Ignored bad PDB record found on line 301  
SSBOND 2 CYS A8 88 CYS A8 100  
  
Ignored bad PDB record found on line 302  
SSBOND 3 CYS AM 18 CYS AM 75  
  
Ignored bad PDB record found on line 303  
SSBOND 4 CYS AM 95 CYS AM 115  
  
Ignored bad PDB record found on line 304  
SSBOND 5 CYS S5 33 CYS S5 66  
  
13 messages similar to the above omitted  
  
Chain information for pdb_extract_25225_aligned-to-153-Comp-
Map_real_space_refined_154_real_space_refined_156-coot-1_real_space_refined_157-coot6_real_space_refined_158.pdb
#6  
---  
Chain | Description  
1 | No description available  
1a | No description available  
2 2a | No description available  
3 | No description available  
3A 3L | No description available  
3B 3M | No description available  
3C 3N | No description available  
3D | No description available  
3E | No description available  
3F | No description available  
3G | No description available  
3H 3S | No description available  
3J | No description available  
3K | No description available  
3O | No description available  
3P | No description available  
3Q | No description available  
3R | No description available  
3T | No description available  
3U | No description available  
3V | No description available  
3a | No description available  
4 4a | No description available  
4L | No description available  
4l | No description available  
5 5a | No description available  
6 | No description available  
6a | No description available  
A | No description available  
A1 | No description available  
A2 a2 | No description available  
A3 a3 | No description available  
A5 | No description available  
A6 | No description available  
A7 | No description available  
A8 | No description available  
A9 a9 | No description available  
AB ab | No description available  
AC ac | No description available  
AL al | No description available  
AM am | No description available  
AN an | No description available  
AO ao | No description available  
B | No description available  
B1 b1 | No description available  
B2 | No description available  
B3 | No description available  
B4 b4 | No description available  
B5 | No description available  
B6 | No description available  
B7 | No description available  
B8 b8 | No description available  
B9 | No description available  
BL | No description available  
BM | No description available  
C1 | No description available  
C2 c2 | No description available  
S1 s1 | No description available  
S2 | No description available  
S3 | No description available  
S4 s4 | No description available  
S5 s5 | No description available  
S6 s6 | No description available  
S7 s7 | No description available  
S8 | No description available  
V1 | No description available  
V2 | No description available  
V3 | No description available  
a1 | No description available  
a5 | No description available  
a6 | No description available  
a7 | No description available  
a8 | No description available  
b2 | No description available  
b3 | No description available  
b5 | No description available  
b6 | No description available  
b7 | No description available  
b9 | No description available  
bl | No description available  
bm | No description available  
c1 | No description available  
s2 | No description available  
s3 | No description available  
s8 | No description available  
v1 | No description available  
v2 | No description available  
v3 | No description available  
  

> hide #!1,6 atoms

> show #6/3A-3V cartoons

> hide #!6 models

> show #!5 models

> hide #!5 models

> show #!5 models

> show #!6 models

> hide #!6 models

> close #6

> open "/Users/apadavan/Desktop/Mouse_Data_Processing /MouseSC-XL-
> Refinement/RealSpaceRefine_158/pdb_extract_25225_aligned-to-153-Comp-
> Map_real_space_refined_154_real_space_refined_156-coot-1_real_space_refined_157-coot6_real_space_refined_158.cif"

Summary of feedback from opening /Users/apadavan/Desktop/Mouse_Data_Processing
/MouseSC-XL-Refinement/RealSpaceRefine_158/pdb_extract_25225_aligned-
to-153-Comp-
Map_real_space_refined_154_real_space_refined_156-coot-1_real_space_refined_157-coot6_real_space_refined_158.cif  
---  
warnings | Skipping chem_comp category: Missing column 'type' on line 1493  
Missing entity information. Treating each chain as a separate entity.  
Invalid residue range for struct_conf "1": invalid chain "3", on line 295  
Invalid residue range for struct_conf "2": invalid chain "3", on line 296  
Invalid residue range for struct_conf "3": invalid chain "3", on line 297  
Invalid residue range for struct_conf "4": invalid chain "3", on line 298  
Invalid residue range for struct_conf "5": invalid chain "3", on line 299  
111 messages similar to the above omitted  
Invalid sheet range for struct_sheet_range "15 1": invalid chain "5", on line
1491  
Missing or incorrect sequence information. Inferred polymer connectivity.  
Skipping chem_comp category: Missing column 'type' on line 164644  
Skipping chem_comp category: Missing column 'type' on line 165329  
Skipping chem_comp category: Missing column 'type' on line 165356  
Skipping chem_comp category: Missing column 'type' on line 165643  
Skipping chem_comp category: Missing column 'type' on line 166226  
9 messages similar to the above omitted  
notes | Fetching CCD 2MR from https://files.wwpdb.org/pub/pdb/refdata/chem_comp/R/2MR/2MR.cif  
Fetching CCD MG from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/G/MG/MG.cif  
Fetching CCD DGT from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/T/DGT/DGT.cif  
Fetching CCD EHZ from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/Z/EHZ/EHZ.cif  
Fetching CCD 3PC from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/C/3PC/3PC.cif  
  
Chain information for pdb_extract_25225_aligned-to-153-Comp-
Map_real_space_refined_154_real_space_refined_156-coot-1_real_space_refined_157-coot6_real_space_refined_158.cif
#6  
---  
Chain | Description  
1 | No description available  
1a | No description available  
2 2a | No description available  
3 | No description available  
3A 3L | No description available  
3B 3M | No description available  
3C 3N | No description available  
3D | No description available  
3E | No description available  
3F | No description available  
3G | No description available  
3H 3S | No description available  
3J | No description available  
3K | No description available  
3O | No description available  
3P | No description available  
3Q | No description available  
3R | No description available  
3T | No description available  
3U | No description available  
3V | No description available  
3a | No description available  
4 4a | No description available  
4L | No description available  
4l | No description available  
5 5a | No description available  
6 | No description available  
6a | No description available  
A | No description available  
A1 | No description available  
A2 a2 | No description available  
A3 a3 | No description available  
A5 | No description available  
A6 | No description available  
A7 | No description available  
A8 | No description available  
A9 a9 | No description available  
AB ab | No description available  
AC ac | No description available  
AL al | No description available  
AM am | No description available  
AN an | No description available  
AO ao | No description available  
B | No description available  
B1 b1 | No description available  
B2 | No description available  
B3 | No description available  
B4 b4 | No description available  
B5 | No description available  
B6 | No description available  
B7 | No description available  
B8 b8 | No description available  
B9 | No description available  
BL | No description available  
BM | No description available  
C1 | No description available  
C2 c2 | No description available  
S1 s1 | No description available  
S2 | No description available  
S3 | No description available  
S4 s4 | No description available  
S5 s5 | No description available  
S6 s6 | No description available  
S7 s7 | No description available  
S8 | No description available  
V1 | No description available  
V2 | No description available  
V3 | No description available  
a1 | No description available  
a5 | No description available  
a6 | No description available  
a7 | No description available  
a8 | No description available  
b2 | No description available  
b3 | No description available  
b5 | No description available  
b6 | No description available  
b7 | No description available  
b9 | No description available  
bl | No description available  
bm | No description available  
c1 | No description available  
s2 | No description available  
s3 | No description available  
s8 | No description available  
v1 | No description available  
v2 | No description available  
v3 | No description available  
  

> hide atoms

> show cartoons

Computing secondary structure  

> hide #!1 models

> hide #!4 models

> hide #!5 models

> close #5

> show #!1 models

> select add #6

162887 atoms, 167122 bonds, 1170 pseudobonds, 20233 residues, 4 models
selected  

> ui mousemode right "rotate selected models"

> view matrix models
> #6,0.89722,0.41077,-0.1621,-10.604,-0.36618,0.89722,0.24679,14,0.24681,-0.16207,0.95542,-1.7882

> view matrix models
> #6,0.037963,0.99886,-0.028924,-3.6354,-0.56484,0.045326,0.82396,43.993,0.82433,-0.014942,0.56591,-22.055

> view matrix models
> #6,0.90998,0.14366,-0.38898,56.171,-0.018946,0.95149,0.3071,-41.753,0.41423,-0.27209,0.86855,6.1617

> ui mousemode right "translate selected models"

> view matrix models
> #6,0.90998,0.14366,-0.38898,215.18,-0.018946,0.95149,0.3071,8.1765,0.41423,-0.27209,0.86855,117.97

> view matrix models
> #6,0.90998,0.14366,-0.38898,328.23,-0.018946,0.95149,0.3071,54.88,0.41423,-0.27209,0.86855,216.49

> ui mousemode right "rotate selected models"

> view matrix models
> #6,0.73957,-0.56064,0.37244,307.78,0.66323,0.70133,-0.26127,98.53,-0.11473,0.44025,0.89052,189.1

> view matrix models
> #6,0.59645,-0.17038,0.78436,211.41,0.72616,0.53087,-0.43688,139.88,-0.34195,0.83015,0.44036,241.71

> view matrix models
> #6,0.71515,0.42018,0.55858,164.6,0.12794,0.70695,-0.6956,229.11,-0.68716,0.56892,0.45181,310.08

> ui mousemode right "translate selected models"

> view matrix models
> #6,0.71515,0.42018,0.55858,114.19,0.12794,0.70695,-0.6956,216.7,-0.68716,0.56892,0.45181,169.87

> select clear

> mmaker #6/3A-3V to #1/3A-3V

Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker pdb_extract_out_coot-39_real_space_refined_031.pdb, chain 3A (#1)
with pdb_extract_25225_aligned-to-153-Comp-
Map_real_space_refined_154_real_space_refined_156-coot-1_real_space_refined_157-coot6_real_space_refined_158.cif,
chain 3A (#6), sequence alignment score = 1555.8  
RMSD between 428 pruned atom pairs is 0.722 angstroms; (across all 441 pairs:
0.924)  
  

> hide cartoons

> show #1/3A-3V cartoons

> show #6/3A-3V cartoons

> show #!3 models

> lighting soft

> volume #3 color #ffffb2

> hide #!1 models

> show #!1 models

> hide #!1 models

> hide #!3 models

> show #!1 models

> hide #!1 models

> show #!1 models

> hide #!6 models

> show #!6 models

> show #!3 models

> hide #!3 models

> show #!3 models

> volume #3 color #ffffb28d

> volume #3 color #ffffb28c

> hide #!4 models

> hide #!6 models

> select #1/3K

Nothing selected  

> select #1/3V

Nothing selected  

> open
> /Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_45/pdb_extract_out_coot-39_real_space_refined_031_real_space_refined_045.cif

Summary of feedback from opening
/Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_45/pdb_extract_out_coot-39_real_space_refined_031_real_space_refined_045.cif  
---  
warnings | Skipping chem_comp category: Missing column 'type' on line 6765  
Missing entity information. Treating each chain as a separate entity.  
Invalid residue range for struct_conf "1": invalid chain "3S", on line 226  
Invalid residue range for struct_conf "2": invalid chain "3S", on line 227  
Invalid residue range for struct_conf "3": invalid chain "3S", on line 228  
Invalid residue range for struct_conf "4": invalid chain "3H", on line 229  
Invalid residue range for struct_conf "5": invalid chain "3H", on line 230  
315 messages similar to the above omitted  
Bad residue range for struct_conf "329" on line 554  
Bad residue range for struct_conf "330" on line 555  
Bad residue range for struct_conf "331" on line 556  
Bad residue range for struct_conf "332" on line 557  
Bad residue range for struct_conf "333" on line 558  
9 messages similar to the above omitted  
Invalid residue range for struct_conf "343": residue in non-polymer entity
"AM", on line 568  
Invalid residue range for struct_conf "344": residue in non-polymer entity
"AM", on line 569  
Invalid residue range for struct_conf "345": residue in non-polymer entity
"AM", on line 570  
Invalid residue range for struct_conf "346": residue in non-polymer entity
"AM", on line 571  
Invalid residue range for struct_conf "347": residue in non-polymer entity
"AM", on line 572  
Bad residue range for struct_conf "350" on line 575  
Bad residue range for struct_conf "351" on line 576  
Bad residue range for struct_conf "353" on line 578  
Bad residue range for struct_conf "354" on line 579  
Bad residue range for struct_conf "355" on line 580  
Invalid residue range for struct_conf "356": invalid chain "B2", on line 581  
Invalid residue range for struct_conf "357": invalid chain "B2", on line 582  
Invalid residue range for struct_conf "358": invalid chain "B2", on line 583  
Invalid residue range for struct_conf "359": invalid chain "B3", on line 584  
Invalid residue range for struct_conf "360": invalid chain "B3", on line 585  
34 messages similar to the above omitted  
Bad residue range for struct_conf "401" on line 626  
Bad residue range for struct_conf "402" on line 627  
Bad residue range for struct_conf "403" on line 628  
Bad residue range for struct_conf "404" on line 629  
Invalid residue range for struct_conf "405": invalid chain "C2", on line 630  
Invalid residue range for struct_conf "406": invalid chain "C2", on line 631  
Invalid residue range for struct_conf "407": invalid chain "C2", on line 632  
Invalid residue range for struct_conf "408": invalid chain "C2", on line 633  
Invalid residue range for struct_conf "409": invalid chain "S1", on line 634  
115 messages similar to the above omitted  
Invalid sheet range for struct_sheet_range "1 1": invalid chain "3A", on line
6519  
Invalid sheet range for struct_sheet_range "1 2": invalid chain "3A", on line
6520  
Invalid sheet range for struct_sheet_range "2 1": invalid chain "3A", on line
6521  
Invalid sheet range for struct_sheet_range "2 2": invalid chain "3A", on line
6522  
Invalid sheet range for struct_sheet_range "2 3": invalid chain "3A", on line
6523  
130 messages similar to the above omitted  
Missing or incorrect sequence information. Inferred polymer connectivity.  
Skipping chem_comp category: Missing column 'type' on line 112035  
Skipping chem_comp category: Missing column 'type' on line 112518  
Skipping chem_comp category: Missing column 'type' on line 112541  
Skipping chem_comp category: Missing column 'type' on line 113162  
Skipping chem_comp category: Missing column 'type' on line 113185  
7 messages similar to the above omitted  
notes | Fetching CCD CU from https://files.wwpdb.org/pub/pdb/refdata/chem_comp/U/CU/CU.cif  
Fetching CCD HEA from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/A/HEA/HEA.cif  
Fetching CCD CUA from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/A/CUA/CUA.cif  
Fetching CCD ATP from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/P/ATP/ATP.cif  
  
Chain information for
pdb_extract_out_coot-39_real_space_refined_031_real_space_refined_045.cif #5  
---  
Chain | Description  
1 | No description available  
2 | No description available  
3 | No description available  
3A 3L | No description available  
3B | No description available  
3C | No description available  
3D | No description available  
3E | No description available  
3F | No description available  
3G | No description available  
3H 3S | No description available  
3J | No description available  
3M | No description available  
3N | No description available  
3O | No description available  
3Q | No description available  
3R | No description available  
3T | No description available  
3U | No description available  
4 | No description available  
4A | No description available  
4B | No description available  
4C | No description available  
4D | No description available  
4E | No description available  
4F | No description available  
4H | No description available  
4I | No description available  
4J | No description available  
4K | No description available  
4L | No description available  
4M | No description available  
4N | No description available  
5 | No description available  
6 | No description available  
A1 | No description available  
A2 | No description available  
A3 | No description available  
A5 | No description available  
A6 | No description available  
A7 | No description available  
A8 | No description available  
A9 | No description available  
AB | No description available  
AC | No description available  
AL | No description available  
AM | No description available  
AN | No description available  
AO | No description available  
B1 | No description available  
B2 | No description available  
B3 | No description available  
B4 | No description available  
B5 | No description available  
B6 | No description available  
B7 | No description available  
B8 | No description available  
B9 | No description available  
BL | No description available  
BM | No description available  
C2 | No description available  
S1 | No description available  
S2 | No description available  
S3 | No description available  
S4 | No description available  
S5 | No description available  
S6 | No description available  
S7 | No description available  
S8 | No description available  
V1 | No description available  
V2 | No description available  
  

> hide #!1 models

> hide #!5 atoms

> show #!5 cartoons

> hide #!5 models

> close #5

> open
> /Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_45/pdb_extract_out_coot-39_real_space_refined_031_real_space_refined_045.pdb

Summary of feedback from opening
/Users/apadavan/Documents/Daphnia_Model_Building/RealSpaceRefine_45/pdb_extract_out_coot-39_real_space_refined_031_real_space_refined_045.pdb  
---  
warnings | Ignored bad PDB record found on line 864  
SSBOND 1 CYS 3S 20 CYS 3S 64  
  
Ignored bad PDB record found on line 865  
SSBOND 2 CYS 3S 26 CYS 3S 60  
  
Ignored bad PDB record found on line 866  
SSBOND 3 CYS 3S 36 CYS 3S 50  
  
Ignored bad PDB record found on line 867  
SSBOND 4 CYS 3H 20 CYS 3H 64  
  
Ignored bad PDB record found on line 868  
SSBOND 5 CYS 3H 26 CYS 3H 60  
  
7 messages similar to the above omitted  
  
Chain information for
pdb_extract_out_coot-39_real_space_refined_031_real_space_refined_045.pdb #5  
---  
Chain | Description  
1 | No description available  
2 | No description available  
3 | No description available  
3A 3L | No description available  
3B | No description available  
3C | No description available  
3D | No description available  
3E | No description available  
3F | No description available  
3G | No description available  
3H 3S | No description available  
3J | No description available  
3M | No description available  
3N | No description available  
3O | No description available  
3Q | No description available  
3R | No description available  
3T | No description available  
3U | No description available  
4 | No description available  
4A | No description available  
4B | No description available  
4C | No description available  
4D | No description available  
4E | No description available  
4F | No description available  
4H | No description available  
4I | No description available  
4J | No description available  
4K | No description available  
4L | No description available  
4M | No description available  
4N | No description available  
5 | No description available  
6 | No description available  
A1 | No description available  
A2 | No description available  
A3 | No description available  
A5 | No description available  
A6 | No description available  
A7 | No description available  
A8 | No description available  
A9 | No description available  
AB | No description available  
AC | No description available  
AL | No description available  
AM | No description available  
AN | No description available  
AO | No description available  
B1 | No description available  
B2 | No description available  
B3 | No description available  
B4 | No description available  
B5 | No description available  
B6 | No description available  
B7 | No description available  
B8 | No description available  
B9 | No description available  
BL | No description available  
BM | No description available  
C2 | No description available  
S1 | No description available  
S2 | No description available  
S3 | No description available  
S4 | No description available  
S5 | No description available  
S6 | No description available  
S7 | No description available  
S8 | No description available  
V1 | No description available  
V2 | No description available  
  

> hide #!5 atoms

> show #!5 cartoons

> close #6

> close #5

> show #!1 models

> show #!3 models

> show #!4 models

> hide #!4 models

> show #!4 models

> hide #!4 models

> show #!4 models

> volume #4 color #b2ffff

> hide #!4 models

> show #!4 models

> volume #3 color #ffffb2

> volume #3 level 0.06689

> volume #3 level 0.1363

> volume #3 level 0.1

> volume #3 level 0.15

> volume #3 level 0.1944

> volume #3 level 0.15

> save /Users/apadavan/Documents/Daphnia_Model_Building/Daphnia-
> Figures/Daphnia-Prep-2-021726.cxs includeMaps true

——— End of log from Thu Feb 19 15:22:31 2026 ———

> view name session-start

opened ChimeraX session  

> rock y 180

> stop

> rock y 60 cycle 30

> stop

> rock y 60 cycle 2

[Repeated 1 time(s)]

> rock y 60 cycle 10

> rock y 60 cycle 2

> rock y 60 cycle 10

[Repeated 1 time(s)]

> stop

> rock y 60 cycle 136

> stop

> rock y 60 cycle 150

> stop

> rock y 60 cycle 150

> stop

> rock y 120 cycle 150

> stop

> rock y 120 cycle 180

>

Incomplete command: movie  

>

Incomplete command: movie  

> movie record

> turn y 2 180

> wait 180

> movie encode /Users/apadavan/Desktop/movie8.mp4

Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/toolbar/tool.py", line 185, in callback  
bundle_info.run_provider(session, name, session.toolbar,
display_name=display_name)  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/core/toolshed/info.py", line 397, in run_provider  
return api._api_caller.run_provider(api, session, name, mgr, **kw)  
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/core/toolshed/__init__.py", line 1419, in run_provider  
return cls._get_func(api, "run_provider")(session, name, mgr, **kw)  
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/shortcuts/__init__.py", line 66, in run_provider  
shortcuts.run_provider(session, name)  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/shortcuts/shortcuts.py", line 1394, in run_provider  
keyboard_shortcuts(session).try_shortcut(name)  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/shortcuts/shortcuts.py", line 403, in try_shortcut  
self.run_shortcut(keys)  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/shortcuts/shortcuts.py", line 421, in run_shortcut  
sc.run(self.session, status = self._enabled)  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/shortcuts/shortcuts.py", line 340, in run  
f(s)  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/shortcuts/shortcuts.py", line 1312, in save_spin_movie  
run(session, cmd)  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/shortcuts/shortcuts.py", line 537, in run  
run_command(session, command, **kw)  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/core/commands/run.py", line 49, in run  
results = command.run(text, log=log, return_json=return_json)  
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/core/commands/cli.py", line 3221, in run  
result = ci.function(session, **kw_args)  
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/movie/moviecmd.py", line 202, in movie_encode  
encode_op(session, output[-1], format, quality, qscale, bitrate,  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/movie/moviecmd.py", line 260, in encode_op  
movie.start_encoding(output, f['ffmpeg_name'], output_size, f['ffmpeg_codec'],
"yuv420p", f['size_restriction'],  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/movie/movie.py", line 324, in start_encoding  
self.encoder.run(Status_Reporter())  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/movie/encode.py", line 232, in run  
p = Popen(self.arg_list, stdin=DEVNULL, stdout=PIPE, stderr=PIPE)  
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/subprocess.py",
line 1026, in __init__  
self._execute_child(args, executable, preexec_fn, close_fds,  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/subprocess.py",
line 1950, in _execute_child  
raise child_exception_type(errno_num, err_msg, err_filename)  
PermissionError: [Errno 13] Permission denied:
'/Applications/ChimeraX-1.10.app/Contents/bin/ffmpeg'  
  
PermissionError: [Errno 13] Permission denied:
'/Applications/ChimeraX-1.10.app/Contents/bin/ffmpeg'  
  
File
"/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/subprocess.py",
line 1950, in _execute_child  
raise child_exception_type(errno_num, err_msg, err_filename)  
  
See log for complete Python traceback.  
  




OpenGL version: 4.1 Metal - 88.1
OpenGL renderer: Apple M1
OpenGL vendor: Apple

Python: 3.11.4
Locale: UTF-8
Qt version: PyQt6 6.8.1, Qt 6.8.2
Qt runtime version: 6.8.2
Qt platform: cocoa
Hardware:

    Hardware Overview:

      Model Name: iMac
      Model Identifier: iMac21,1
      Model Number: Z12R000LXLL/A
      Chip: Apple M1
      Total Number of Cores: 8 (4 performance and 4 efficiency)
      Memory: 16 GB
      System Firmware Version: 10151.121.1
      OS Loader Version: 10151.121.1

Software:

    System Software Overview:

      System Version: macOS 14.5 (23F79)
      Kernel Version: Darwin 23.5.0
      Time since boot: 24 days, 3 hours, 51 minutes

Graphics/Displays:

    Apple M1:

      Chipset Model: Apple M1
      Type: GPU
      Bus: Built-In
      Total Number of Cores: 8
      Vendor: Apple (0x106b)
      Metal Support: Metal 3
      Displays:
        iMac:
          Display Type: Built-In Retina LCD
          Resolution: Retina 4.5K (4480 x 2520)
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Automatically Adjust Brightness: Yes
          Connection Type: Internal
        HP VH240a:
          Resolution: 1920 x 1080 (1080p FHD - Full High Definition)
          UI Looks like: 1920 x 1080 @ 60.00Hz
          Mirror: Off
          Online: Yes
          Rotation: Supported


Installed Packages:
    alabaster: 1.0.0
    appdirs: 1.4.4
    appnope: 0.1.4
    asttokens: 3.0.0
    auditwheel: 6.4.0
    babel: 2.17.0
    beautifulsoup4: 4.13.3
    blockdiag: 3.0.0
    blosc2: 3.5.0
    build: 1.2.2.post1
    certifi: 2023.11.17
    cftime: 1.6.4.post1
    charset-normalizer: 3.4.2
    ChimeraX-AddCharge: 1.5.19
    ChimeraX-AddH: 2.2.7
    ChimeraX-AlignmentAlgorithms: 2.0.2
    ChimeraX-AlignmentHdrs: 3.6.1
    ChimeraX-AlignmentMatrices: 2.1
    ChimeraX-Alignments: 2.20.2
    ChimeraX-AlphaFold: 1.0.1
    ChimeraX-AltlocExplorer: 1.1.2
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Aniso: 1.1.4
    ChimeraX-Arrays: 1.1
    ChimeraX-Atomic: 1.60.7
    ChimeraX-AtomicLibrary: 14.1.18
    ChimeraX-AtomSearch: 2.0.1
    ChimeraX-AxesPlanes: 2.4
    ChimeraX-BasicActions: 1.1.3
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 3.0.0
    ChimeraX-Boltz: 1.0
    ChimeraX-BondRot: 2.0.4
    ChimeraX-BugReporter: 1.0.2
    ChimeraX-BuildStructure: 2.13.1
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.5.1
    ChimeraX-ButtonPanel: 1.0.1
    ChimeraX-CageBuilder: 1.0.1
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.4
    ChimeraX-ChangeChains: 1.1
    ChimeraX-CheckWaters: 1.5
    ChimeraX-ChemGroup: 2.0.2
    ChimeraX-Clashes: 2.3
    ChimeraX-ColorActions: 1.0.5
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.5.8
    ChimeraX-CommandLine: 1.3
    ChimeraX-ConnectStructure: 2.0.1
    ChimeraX-Contacts: 1.0.1
    ChimeraX-Core: 1.10
    ChimeraX-CoreFormats: 1.2
    ChimeraX-coulombic: 1.4.5
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
    ChimeraX-CrystalContacts: 1.0.1
    ChimeraX-DataFormats: 1.2.4
    ChimeraX-Dicom: 1.2.7
    ChimeraX-DistMonitor: 1.4.2
    ChimeraX-DockPrep: 1.1.4
    ChimeraX-Dssp: 2.0
    ChimeraX-EMDB-SFF: 1.0
    ChimeraX-ESMFold: 1.0
    ChimeraX-FileHistory: 1.0.1
    ChimeraX-FunctionKey: 1.0.1
    ChimeraX-Geometry: 1.3
    ChimeraX-gltf: 1.0
    ChimeraX-Graphics: 1.4.1
    ChimeraX-Hbonds: 2.5.1
    ChimeraX-Help: 1.3
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.1
    ChimeraX-ImageFormats: 1.2
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.3
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-IUPAC: 1.0
    ChimeraX-KVFinder: 1.6.2
    ChimeraX-Label: 1.1.14
    ChimeraX-ListInfo: 1.2.2
    ChimeraX-Log: 1.2
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.9.1
    ChimeraX-Map: 1.3
    ChimeraX-MapData: 2.0
    ChimeraX-MapEraser: 1.0.1
    ChimeraX-MapFilter: 2.0.1
    ChimeraX-MapFit: 2.0
    ChimeraX-MapSeries: 2.1.1
    ChimeraX-Markers: 1.0.1
    ChimeraX-Mask: 1.0.2
    ChimeraX-MatchMaker: 2.2.2
    ChimeraX-MCopy: 1.0
    ChimeraX-MDcrds: 2.10.1
    ChimeraX-MedicalToolbar: 1.1
    ChimeraX-Meeting: 1.0.1
    ChimeraX-MLP: 1.1.1
    ChimeraX-mmCIF: 2.16
    ChimeraX-MMTF: 2.2
    ChimeraX-ModelArchive: 1.0
    ChimeraX-Modeller: 1.5.19
    ChimeraX-ModelPanel: 1.5.1
    ChimeraX-ModelSeries: 1.0.1
    ChimeraX-Mol2: 2.0.3
    ChimeraX-Mole: 1.0
    ChimeraX-Morph: 1.0.2
    ChimeraX-MouseModes: 1.2
    ChimeraX-Movie: 1.0
    ChimeraX-MutationScores: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nifti: 1.2
    ChimeraX-NMRSTAR: 1.0.2
    ChimeraX-NRRD: 1.2
    ChimeraX-Nucleotides: 2.0.3
    ChimeraX-OpenCommand: 1.14.1
    ChimeraX-OrthoPick: 1.0.1
    ChimeraX-PDB: 2.7.10
    ChimeraX-PDBBio: 1.0.1
    ChimeraX-PDBLibrary: 1.0.4
    ChimeraX-PDBMatrices: 1.0
    ChimeraX-PickBlobs: 1.0.1
    ChimeraX-Positions: 1.0
    ChimeraX-PresetMgr: 1.1.3
    ChimeraX-ProfileGrids: 1.1.2
    ChimeraX-PubChem: 2.2
    ChimeraX-ReadPbonds: 1.0.1
    ChimeraX-Registration: 1.1.2
    ChimeraX-RemoteControl: 1.0
    ChimeraX-RenderByAttr: 1.6.3
    ChimeraX-RenumberResidues: 1.1
    ChimeraX-ResidueFit: 1.0.1
    ChimeraX-RestServer: 1.3.1
    ChimeraX-RNALayout: 1.0
    ChimeraX-RotamerLibMgr: 4.0
    ChimeraX-RotamerLibsDunbrack: 2.0
    ChimeraX-RotamerLibsDynameomics: 2.0
    ChimeraX-RotamerLibsRichardson: 2.0
    ChimeraX-SaveCommand: 1.5.1
    ChimeraX-SchemeMgr: 1.0
    ChimeraX-SDF: 2.0.3
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0.1
    ChimeraX-Segmentations: 3.5.7
    ChimeraX-SelInspector: 1.0
    ChimeraX-SeqView: 2.17.1
    ChimeraX-Shape: 1.1
    ChimeraX-Shell: 1.0.1
    ChimeraX-Shortcuts: 1.2.1
    ChimeraX-ShowSequences: 1.0.3
    ChimeraX-SideView: 1.0.1
    ChimeraX-SimilarStructures: 1.0.1
    ChimeraX-Smiles: 2.1.2
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.19.1
    ChimeraX-STL: 1.0.1
    ChimeraX-Storm: 1.0
    ChimeraX-StructMeasure: 1.2.1
    ChimeraX-Struts: 1.0.1
    ChimeraX-Surface: 1.0.1
    ChimeraX-SwapAA: 2.0.1
    ChimeraX-SwapRes: 2.5.2
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-TaskManager: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.2.3
    ChimeraX-ToolshedUtils: 1.2.4
    ChimeraX-Topography: 1.0
    ChimeraX-ToQuest: 1.0
    ChimeraX-Tug: 1.0.1
    ChimeraX-UI: 1.45.2
    ChimeraX-Umap: 1.0
    ChimeraX-uniprot: 2.3.1
    ChimeraX-UnitCell: 1.0.1
    ChimeraX-ViewDockX: 1.4.4
    ChimeraX-VIPERdb: 1.0
    ChimeraX-Vive: 1.1
    ChimeraX-VolumeMenu: 1.0.1
    ChimeraX-vrml: 1.0
    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0.2
    ChimeraX-WebServices: 1.1.5
    ChimeraX-Zone: 1.0.1
    colorama: 0.4.6
    comm: 0.2.2
    contourpy: 1.3.2
    coverage: 7.9.1
    cxservices: 1.2.3
    cycler: 0.12.1
    Cython: 3.0.12
    debugpy: 1.8.14
    decorator: 5.2.1
    docutils: 0.21.2
    executing: 2.2.0
    filelock: 3.18.0
    fonttools: 4.58.4
    funcparserlib: 2.0.0a0
    glfw: 2.9.0
    grako: 3.16.5
    h5py: 3.14.0
    html2text: 2024.2.26
    idna: 3.10
    ihm: 2.2
    imagecodecs: 2024.6.1
    imagesize: 1.4.1
    iniconfig: 2.1.0
    ipykernel: 6.29.5
    ipython: 8.26.0
    ipywidgets: 8.1.7
    jedi: 0.19.1
    Jinja2: 3.1.6
    jupyter_client: 8.6.3
    jupyter_core: 5.8.1
    jupyterlab_widgets: 3.0.15
    kiwisolver: 1.4.8
    line_profiler: 4.2.0
    lxml: 5.3.1
    lz4: 4.4.4
    MarkupSafe: 3.0.2
    matplotlib: 3.10.1
    matplotlib-inline: 0.1.7
    msgpack: 1.1.0
    ndindex: 1.10.0
    nest-asyncio: 1.6.0
    netCDF4: 1.6.5
    networkx: 3.3
    nibabel: 5.2.0
    nptyping: 2.5.0
    numexpr: 2.11.0
    numpy: 1.26.4
    OpenMM: 8.2.0
    openvr: 1.26.701
    packaging: 24.2
    ParmEd: 4.2.2
    parso: 0.8.4
    pep517: 0.13.1
    pexpect: 4.9.0
    pickleshare: 0.7.5
    pillow: 10.4.0
    pip: 25.0.1
    pkginfo: 1.11.1
    platformdirs: 4.3.8
    pluggy: 1.6.0
    prompt_toolkit: 3.0.51
    psutil: 7.0.0
    ptyprocess: 0.7.0
    pure_eval: 0.2.3
    py-cpuinfo: 9.0.0
    pycollada: 0.8
    pydicom: 2.4.4
    pyelftools: 0.32
    Pygments: 2.18.0
    pynmrstar: 3.3.5
    pynrrd: 1.0.0
    PyOpenGL: 3.1.9
    PyOpenGL-accelerate: 3.1.9
    pyopenxr: 1.1.4501
    pyparsing: 3.2.3
    pyproject_hooks: 1.2.0
    PyQt6-commercial: 6.8.1
    PyQt6-Qt6: 6.8.2
    PyQt6-WebEngine-commercial: 6.8.0
    PyQt6-WebEngine-Qt6: 6.8.2
    PyQt6_sip: 13.10.0
    pytest: 8.4.1
    pytest-cov: 6.2.1
    python-dateutil: 2.9.0.post0
    pytz: 2025.2
    pyzmq: 27.0.0
    qtconsole: 5.5.2
    QtPy: 2.4.3
    qtshim: 1.1
    RandomWords: 0.4.0
    requests: 2.32.3
    roman-numerals-py: 3.1.0
    scipy: 1.14.0
    setuptools: 78.1.0
    sfftk-rw: 0.8.1
    six: 1.16.0
    snowballstemmer: 3.0.1
    sortedcontainers: 2.4.0
    soupsieve: 2.7
    Sphinx: 8.2.3
    sphinx-autodoc-typehints: 3.1.0
    sphinxcontrib-applehelp: 2.0.0
    sphinxcontrib-blockdiag: 3.0.0
    sphinxcontrib-devhelp: 2.0.0
    sphinxcontrib-htmlhelp: 2.1.0
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 2.0.0
    sphinxcontrib-serializinghtml: 2.0.0
    stack-data: 0.6.3
    superqt: 0.7.1
    tables: 3.10.2
    tcia_utils: 1.5.1
    tifffile: 2025.3.13
    tinyarray: 1.2.4
    tornado: 6.5.1
    traitlets: 5.14.3
    typing_extensions: 4.14.0
    tzdata: 2025.2
    urllib3: 2.5.0
    wcwidth: 0.2.13
    webcolors: 24.11.1
    wheel: 0.45.1
    wheel-filename: 1.4.2
    widgetsnbextension: 4.0.14

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