Opened 2 years ago

Closed 2 years ago

#9498 closed defect (limitation)

Restore new session in old ChimeraX

Reported by: chimerax-bug-report@… Owned by: pett
Priority: normal Milestone:
Component: Sessions Version:
Keywords: Cc:
Blocked By: Blocking:
Notify when closed: Platform: all
Project: ChimeraX

Description

The following bug report has been submitted:
Platform:        macOS-10.16-x86_64-i386-64bit
ChimeraX Version: 1.5 (2022-11-24 00:03:27 UTC)
Description
(Describe the actions that caused this problem to occur here)

Log:
UCSF ChimeraX version: 1.5 (2022-11-24)  
© 2016-2022 Regents of the University of California. All rights reserved.  

> open /Users/jng994/Desktop/paborra/lr4_fb123_02s.cxs

Opened map_b1_lr4_fb1_3o21_17k_locref_sh as #1, grid size 239,241,483, pixel
0.728, shown at level 0.1, step 1, values float32  
Opened map_b1_cast_04Bb1_3o23_17k_nu_sh as #3, grid size 239,241,483, pixel
0.728, shown at level 0.08, step 1, values float32  
Opened map_b2_lr4_fb2_3o74_20k_locref_sh as #4, grid size 239,241,483, pixel
0.728, shown at level 0.1, step 1, values float32  
Opened map_b2_cast_04Bb2_3o27_20k_nus_sh as #6, grid size 239,241,483, pixel
0.728, shown at level 0.07, step 1, values float32  
Opened map_b3_lr4_fb3_4o00_19k_locref_sh as #7, grid size 239,241,483, pixel
0.728, shown at level 0.05, step 1, values float32  
Opened map_b3_cast_04Bb3_3o53_19k_nu_sh as #9, grid size 239,241,483, pixel
0.728, shown at level 0.06, step 1, values float32  
Log from Tue Aug 1 12:56:49 2023UCSF ChimeraX version: 1.7.dev202305042315
(2023-05-04)  
© 2016-2023 Regents of the University of California. All rights reserved.  

> open /Users/pmesa/Desktop/lr4_fb123/lr4_fb123_02s.cxs

Opened map_b1_lr4_fb1_3o21_17k_locref_sh as #1, grid size 239,241,483, pixel
0.728, shown at level 0.1, step 1, values float32  
Opened map_b1_cast_04Bb1_3o23_17k_nu_sh as #3, grid size 239,241,483, pixel
0.728, shown at level 0.08, step 1, values float32  
Opened map_b2_lr4_fb2_3o74_20k_locref_sh as #4, grid size 239,241,483, pixel
0.728, shown at level 0.1, step 1, values float32  
Opened map_b2_cast_04Bb2_3o27_20k_nus_sh as #6, grid size 239,241,483, pixel
0.728, shown at level 0.07, step 1, values float32  
Opened map_b3_lr4_fb3_4o00_19k_locref_sh as #7, grid size 239,241,483, pixel
0.728, shown at level 0.05, step 1, values float32  
Opened map_b3_cast_04Bb3_3o53_19k_nu_sh as #9, grid size 239,241,483, pixel
0.728, shown at level 0.06, step 1, values float32  
Log from Mon Jul 31 20:30:42 2023UCSF ChimeraX version: 1.7.dev202305042315
(2023-05-04)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb1_3o21_17k_J1695/lr4_fb1_3o21_17k_J1695_005_sls_mb20.ccp4

Opened lr4_fb1_3o21_17k_J1695_005_sls_mb20.ccp4 as #1, grid size 239,241,483,
pixel 0.728, shown at level 0.0992, step 2, values float32  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb1_3o21_17k_J1695/lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb

Chain information for lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb #2  
---  
Chain | Description  
2 | No description available  
3 | No description available  
4 | No description available  
5 | No description available  
6 | No description available  
7 | No description available  
R | No description available  
S | No description available  
T | No description available  
U | No description available  
  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb2_3o74_20k_J1693/lr4_fb2_3o74_20k_J1693_006_sls_mb20.ccp4

Opened lr4_fb2_3o74_20k_J1693_006_sls_mb20.ccp4 as #3, grid size 239,241,483,
pixel 0.728, shown at level 0.072, step 2, values float32  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb2_3o74_20k_J1693/lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb

Chain information for lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb #4  
---  
Chain | Description  
2 | No description available  
3 | No description available  
4 | No description available  
5 | No description available  
6 | No description available  
7 | No description available  
R | No description available  
S | No description available  
T | No description available  
U | No description available  
  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb3_4o00_19k_J1694/lr4_fb3_4o00_19k_J1694_005_sls_mb20.ccp4

Opened lr4_fb3_4o00_19k_J1694_005_sls_mb20.ccp4 as #5, grid size 239,241,483,
pixel 0.728, shown at level 0.0639, step 2, values float32  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb3_4o00_19k_J1694/lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb

Chain information for lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb #6  
---  
Chain | Description  
2 | No description available  
3 | No description available  
4 | No description available  
5 | No description available  
6 | No description available  
7 | No description available  
R | No description available  
S | No description available  
T | No description available  
U | No description available  
  

> close session

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb1_3o21_17k_J1695/lr4_fb1_3o21_17k_J1695_005_sls_mb20.ccp4

Opened lr4_fb1_3o21_17k_J1695_005_sls_mb20.ccp4 as #1, grid size 239,241,483,
pixel 0.728, shown at level 0.0992, step 2, values float32  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb1_3o21_17k_J1695/lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb

Chain information for lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb #2  
---  
Chain | Description  
2 | No description available  
3 | No description available  
4 | No description available  
5 | No description available  
6 | No description available  
7 | No description available  
R | No description available  
S | No description available  
T | No description available  
U | No description available  
  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_nu/cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4

Opened cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4 as #3, grid size
239,241,483, pixel 0.728, shown at level 0.138, step 2, values float32  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb2_3o74_20k_J1693/lr4_fb2_3o74_20k_J1693_006_sls_mb20.ccp4

Opened lr4_fb2_3o74_20k_J1693_006_sls_mb20.ccp4 as #4, grid size 239,241,483,
pixel 0.728, shown at level 0.072, step 2, values float32  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb2_3o74_20k_J1693/lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb

Chain information for lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb #5  
---  
Chain | Description  
2 | No description available  
3 | No description available  
4 | No description available  
5 | No description available  
6 | No description available  
7 | No description available  
R | No description available  
S | No description available  
T | No description available  
U | No description available  
  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_nu/cast_04Bb2_3o27_20k_J1629_007_nus_mb20.ccp4

Opened cast_04Bb2_3o27_20k_J1629_007_nus_mb20.ccp4 as #6, grid size
239,241,483, pixel 0.728, shown at level 0.133, step 2, values float32  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb3_4o00_19k_J1694/lr4_fb3_4o00_19k_J1694_005_sls_mb20.ccp4

Opened lr4_fb3_4o00_19k_J1694_005_sls_mb20.ccp4 as #7, grid size 239,241,483,
pixel 0.728, shown at level 0.0639, step 2, values float32  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb3_4o00_19k_J1694/lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb

Chain information for lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb #8  
---  
Chain | Description  
2 | No description available  
3 | No description available  
4 | No description available  
5 | No description available  
6 | No description available  
7 | No description available  
R | No description available  
S | No description available  
T | No description available  
U | No description available  
  

> open
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_nu/cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4

Opened cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4 as #9, grid size
239,241,483, pixel 0.728, shown at level 0.11, step 2, values float32  

> hide atoms

> show cartoons

> hide #!2 models

> hide #!3 models

> hide #!4 models

> hide #!5 models

> hide #!6 models

> hide #!7 models

> hide #!8 models

> hide #!9 models

> volume step 1 level 0.1

> show #!3 models

> hide #!1 models

> volume #3 level 0.08

> show #!1 models

> hide #!3 models

> hide #!1 models

> show #!3 models

> show #!6 models

> open
> D:/Docs/phenix_projects/cast/L5_locref/L5_msLC_a258_2o35_258k/L5_msLC_a258_2o35_258k_r14.pdb

Chain information for L5_msLC_a258_2o35_258k_r14.pdb #10  
---  
Chain | Description  
2 | No description available  
3 | No description available  
C | No description available  
D E F G H I J K L M N O P Q | No description available  
  

> hide #10 atoms

> show #10 cartoons

> hide #!6 models

> hide #10 models

> show #10 models

> combine #10 name C_b1

> combine #10 name C_b2

> combine #10 name C_b3

> hide #10 models

> hide #12 models

> hide #13 models

> show #11 cartoons

> hide #!3 models

> show #!3 models

> hide #!3 models

> show #!3 models

> color #11 #5500ffff

> color #11 blue

> color #12 blue

> color #13 blue

> ui tool show "Fit in Map"

> fitmap #11 inMap #3

Fit molecule C_b1 (#11) to map cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4
(#3) using 30566 atoms  
average map value = 0.1318, steps = 68  
shifted from previous position = 0.451  
rotated from previous position = 0.77 degrees  
atoms outside contour = 8786, contour level = 0.08  
  
Position of C_b1 (#11) relative to cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4
(#3) coordinates:  
Matrix rotation and translation  
0.99992867 0.00343305 -0.01143973 2.30076649  
-0.00350360 0.99997493 -0.00615264 2.56653273  
0.01141832 0.00619228 0.99991564 -5.83459619  
Axis 0.45911096 -0.85009737 -0.25797595  
Axis point 503.75729464 0.00000000 182.74156770  
Rotation angle (degrees) 0.77032897  
Shift along axis 0.37968987  
  

> volume #3 style mesh

> volume #3 style surface

> fitmap #11 inMap #3

Fit molecule C_b1 (#11) to map cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4
(#3) using 30566 atoms  
average map value = 0.1318, steps = 40  
shifted from previous position = 0.0121  
rotated from previous position = 0.00475 degrees  
atoms outside contour = 8792, contour level = 0.08  
  
Position of C_b1 (#11) relative to cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4
(#3) coordinates:  
Matrix rotation and translation  
0.99992807 0.00344207 -0.01148980 2.32341805  
-0.00351218 0.99997531 -0.00608718 2.55526260  
0.01146857 0.00612709 0.99991546 -5.83144971  
Axis 0.45374019 -0.85286614 -0.25833928  
Axis point 501.23696864 0.00000000 184.01488525  
Rotation angle (degrees) 0.77119800  
Shift along axis 0.38142373  
  

> fitmap #11 inMap #3

Fit molecule C_b1 (#11) to map cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4
(#3) using 30566 atoms  
average map value = 0.1318, steps = 40  
shifted from previous position = 0.00454  
rotated from previous position = 0.00552 degrees  
atoms outside contour = 8794, contour level = 0.08  
  
Position of C_b1 (#11) relative to cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4
(#3) coordinates:  
Matrix rotation and translation  
0.99992807 0.00343105 -0.01149296 2.32491120  
-0.00350228 0.99997475 -0.00618304 2.57897148  
0.01147146 0.00622284 0.99991484 -5.85975271  
Axis 0.45936957 -0.85033484 -0.25672994  
Axis point 503.68698321 0.00000000 183.97392030  
Rotation angle (degrees) 0.77369760  
Shift along axis 0.37937813  
  

> show #!6 models

> hide #!3 models

> show #12 models

> hide #11 models

> fitmap #12 inMap #6

Fit molecule C_b2 (#12) to map cast_04Bb2_3o27_20k_J1629_007_nus_mb20.ccp4
(#6) using 30566 atoms  
average map value = 0.1327, steps = 60  
shifted from previous position = 0.827  
rotated from previous position = 1.34 degrees  
atoms outside contour = 11792, contour level = 0.1  
  
Position of C_b2 (#12) relative to cast_04Bb2_3o27_20k_J1629_007_nus_mb20.ccp4
(#6) coordinates:  
Matrix rotation and translation  
0.99977296 -0.00203703 -0.02121028 7.72839573  
0.00183604 0.99995327 -0.00949132 2.00530768  
0.02122862 0.00945022 0.99972998 -9.86383697  
Axis 0.40616404 -0.91001835 0.08305044  
Axis point 471.03428505 0.00000000 349.85065127  
Rotation angle (degrees) 1.33612135  
Shift along axis 0.49493361  
  

> volume #6 style mesh

> volume #6 style surface

> show #!9 models

> hide #!6 models

> show #13 models

> hide #12 models

> fitmap #13 inMap #9

Fit molecule C_b3 (#13) to map cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4
(#9) using 30566 atoms  
average map value = 0.08978, steps = 48  
shifted from previous position = 1.05  
rotated from previous position = 0.21 degrees  
atoms outside contour = 18459, contour level = 0.1  
  
Position of C_b3 (#13) relative to cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4
(#9) coordinates:  
Matrix rotation and translation  
0.99999654 0.00239315 -0.00109287 -0.65765108  
-0.00239594 0.99999387 -0.00255445 0.48262693  
0.00108675 0.00255706 0.99999614 -1.21539230  
Axis 0.69679116 -0.29712256 -0.65284015  
Axis point 0.00000000 426.65509987 210.22243973  
Rotation angle (degrees) 0.21015493  
Shift along axis 0.19181208  
  

> fitmap #13 inMap #9

Fit molecule C_b3 (#13) to map cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4
(#9) using 30566 atoms  
average map value = 0.08978, steps = 40  
shifted from previous position = 0.00866  
rotated from previous position = 0.0104 degrees  
atoms outside contour = 18462, contour level = 0.1  
  
Position of C_b3 (#13) relative to cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4
(#9) coordinates:  
Matrix rotation and translation  
0.99999635 0.00240337 -0.00123210 -0.61668846  
-0.00240665 0.99999354 -0.00267127 0.52291640  
0.00122567 0.00267422 0.99999567 -1.30424488  
Axis 0.70340716 -0.32341564 -0.63294604  
Axis point 0.00000000 435.37955227 221.65489655  
Rotation angle (degrees) 0.21770788  
Shift along axis 0.22261421  
  

> volume #9 style mesh

> volume #9 style surface

> volume #9 level 0.08

> volume #9 level 0.06

> show #!6 models

> hide #!9 models

> volume #6 level 0.06

> volume #6 level 0.07

> show #!9 models

> show #!3 models

> hide #!6 models

> hide #!9 models

> save
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb123/lr4_fb123_01.cxs
> includeMaps true

> set bgColor white

> set bgColor black

> hide #13 models

> show #11 models

> show #!6 models

> show #12 models

> hide #!3 models

> hide #!6 models

> show #13 models

> hide #13 models

> hide #12 models

> show #12 models

> show #13 models

> hide #13 models

> hide #12 models

> show #12 models

> show #13 models

> show #!3 models

> show #!6 models

> hide #13 models

> mmaker #12 to #11 bring #6 pairing ss

Using Nucleic matrix instead of BLOSUM-62 to match C_b2 #12/2 to C_b1 #11/2  
Using Nucleic matrix instead of BLOSUM-62 to match C_b2 #12/3 to C_b1 #11/3  
Parameters  
---  
Chain pairing | ss  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | Nucleic  
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 C_b1, chain 2 (#11) with C_b2, chain 2 (#12), sequence alignment
score = 100  
Matchmaker C_b1, chain 3 (#11) with C_b2, chain 3 (#12), sequence alignment
score = 104  
Matchmaker C_b1, chain C (#11) with C_b2, chain C (#12), sequence alignment
score = 53.3  
Matchmaker C_b1, chain D (#11) with C_b2, chain D (#12), sequence alignment
score = 1329.4  
Matchmaker C_b1, chain E (#11) with C_b2, chain E (#12), sequence alignment
score = 1326.4  
Matchmaker C_b1, chain F (#11) with C_b2, chain F (#12), sequence alignment
score = 1325.8  
Matchmaker C_b1, chain G (#11) with C_b2, chain G (#12), sequence alignment
score = 1325.8  
Matchmaker C_b1, chain H (#11) with C_b2, chain H (#12), sequence alignment
score = 1325.2  
Matchmaker C_b1, chain I (#11) with C_b2, chain I (#12), sequence alignment
score = 1328.8  
Matchmaker C_b1, chain J (#11) with C_b2, chain J (#12), sequence alignment
score = 1327.6  
Matchmaker C_b1, chain K (#11) with C_b2, chain K (#12), sequence alignment
score = 1325.2  
Matchmaker C_b1, chain L (#11) with C_b2, chain L (#12), sequence alignment
score = 1324  
Matchmaker C_b1, chain M (#11) with C_b2, chain M (#12), sequence alignment
score = 1327  
Matchmaker C_b1, chain N (#11) with C_b2, chain N (#12), sequence alignment
score = 1326.4  
Matchmaker C_b1, chain O (#11) with C_b2, chain O (#12), sequence alignment
score = 1325.2  
Matchmaker C_b1, chain P (#11) with C_b2, chain P (#12), sequence alignment
score = 1326.4  
Matchmaker C_b1, chain Q (#11) with C_b2, chain Q (#12), sequence alignment
score = 1322.8  
RMSD between 3659 pruned atom pairs is 0.000 angstroms; (across all 3659
pairs: 0.000)  
  

> hide #!6 models

> hide #!3 models

> hide #12 models

> show #12 models

> show #!3 models

> show #!6 models

> hide #!3 models

> show #!3 models

> hide #!3 models

> show #!3 models

> hide #!6 models

> show #!6 models

> hide #!6 models

> show #!6 models

> hide #!6 models

> show #!6 models

> hide #!6 models

> show #!6 models

> hide #!6 models

> show #!6 models

> hide #!6 models

> show #!6 models

> hide #!3 models

> show #!3 models

> hide #!6 models

> show #!6 models

> hide #!6 models

> show #!6 models

> hide #!6 models

> show #!6 models

> hide #!6 models

> show #!6 models

> hide #!3 models

> show #!3 models

> hide #!3 models

> show #!3 models

> hide #!3 models

> hide #!6 models

> show #!3 models

> show #!9 models

> hide #12 models

> show #13 models

> mmaker #13 to #11 bring #9 pairing ss

Using Nucleic matrix instead of BLOSUM-62 to match C_b3 #13/2 to C_b1 #11/2  
Using Nucleic matrix instead of BLOSUM-62 to match C_b3 #13/3 to C_b1 #11/3  
Parameters  
---  
Chain pairing | ss  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | Nucleic  
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 C_b1, chain 2 (#11) with C_b3, chain 2 (#13), sequence alignment
score = 100  
Matchmaker C_b1, chain 3 (#11) with C_b3, chain 3 (#13), sequence alignment
score = 104  
Matchmaker C_b1, chain C (#11) with C_b3, chain C (#13), sequence alignment
score = 53.3  
Matchmaker C_b1, chain D (#11) with C_b3, chain D (#13), sequence alignment
score = 1329.4  
Matchmaker C_b1, chain E (#11) with C_b3, chain E (#13), sequence alignment
score = 1326.4  
Matchmaker C_b1, chain F (#11) with C_b3, chain F (#13), sequence alignment
score = 1325.8  
Matchmaker C_b1, chain G (#11) with C_b3, chain G (#13), sequence alignment
score = 1325.8  
Matchmaker C_b1, chain H (#11) with C_b3, chain H (#13), sequence alignment
score = 1325.2  
Matchmaker C_b1, chain I (#11) with C_b3, chain I (#13), sequence alignment
score = 1328.8  
Matchmaker C_b1, chain J (#11) with C_b3, chain J (#13), sequence alignment
score = 1327.6  
Matchmaker C_b1, chain K (#11) with C_b3, chain K (#13), sequence alignment
score = 1325.2  
Matchmaker C_b1, chain L (#11) with C_b3, chain L (#13), sequence alignment
score = 1324  
Matchmaker C_b1, chain M (#11) with C_b3, chain M (#13), sequence alignment
score = 1327  
Matchmaker C_b1, chain N (#11) with C_b3, chain N (#13), sequence alignment
score = 1326.4  
Matchmaker C_b1, chain O (#11) with C_b3, chain O (#13), sequence alignment
score = 1325.2  
Matchmaker C_b1, chain P (#11) with C_b3, chain P (#13), sequence alignment
score = 1326.4  
Matchmaker C_b1, chain Q (#11) with C_b3, chain Q (#13), sequence alignment
score = 1322.8  
RMSD between 3659 pruned atom pairs is 0.000 angstroms; (across all 3659
pairs: 0.000)  
  

> hide #!9 models

> hide #!3 models

> hide #13 models

> show #13 models

> show #12 models

> hide #12 models

> hide #13 models

> hide #11 models

> show #!3 models

> show #!6 models

> show #!9 models

> hide #!6 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!3 models

> show #!3 models

> hide #!3 models

> show #!3 models

> hide #!3 models

> show #!3 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!3 models

> show #!3 models

> hide #!3 models

> show #!3 models

> hide #!3 models

> show #!3 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> show #13 models

> hide #!3 models

> show #!6 models

> show #!3 models

> save
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb123/lr4_fb123_01.cxs
> includeMaps true

> hide #13 models

> combine #2 cast_b1

Expected a keyword  

> combine #2 name cast_b1

> hide #!3 models

> hide #!6 models

> hide #!9 models

> show #!6 models

> hide #!6 models

> show #!5 models

> hide #!14 models

> combine #5 name cast_b2

> hide #!5 models

> show #!14 models

> hide #!15 models

> hide #!14 models

> show #!8 models

> combine #8 name cast_b3

> show #!15 models

> show #!14 models

> hide #!16 models

> hide #!15 models

> hide #!14 models

> hide #!8 models

> show #!1 models

> show #!14 models

> hide #!1 models

> show #!3 models

> ui tool show "Fit in Map"

> fitmap #14 inMap #3

Fit molecule cast_b1 (#14) to map cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4
(#3) using 16478 atoms  
average map value = 0.07375, steps = 96  
shifted from previous position = 1.04  
rotated from previous position = 1.17 degrees  
atoms outside contour = 10262, contour level = 0.08  
  
Position of cast_b1 (#14) relative to
cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4 (#3) coordinates:  
Matrix rotation and translation  
0.99989265 -0.01181117 -0.00867129 5.74552132  
0.01193361 0.99982788 0.01420595 -6.58777238  
0.00850201 -0.01430790 0.99986149 0.64897185  
Axis -0.69737573 -0.42001474 0.58073635  
Axis point 0.00000000 75.63807843 490.16369044  
Rotation angle (degrees) 1.17141827  
Shift along axis -0.86294405  
  

> hide #!3 models

> show #!3 models

> volume #3 style mesh

> volume #3 style surface

> volume #3 style mesh

> volume #3 style surface

> fitmap #14 inMap #3

Fit molecule cast_b1 (#14) to map cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4
(#3) using 16478 atoms  
average map value = 0.07375, steps = 96  
shifted from previous position = 0.0115  
rotated from previous position = 0.0135 degrees  
atoms outside contour = 10251, contour level = 0.08  
  
Position of cast_b1 (#14) relative to
cast_04Bb1_3o23_17k_J1635_005_nus_mb20.ccp4 (#3) coordinates:  
Matrix rotation and translation  
0.99989392 -0.01186850 -0.00844366 5.70823268  
0.01198789 0.99982685 0.01423251 -6.61263510  
0.00827328 -0.01433222 0.99986306 0.73537635  
Axis -0.70013949 -0.40974286 0.58473539  
Axis point 0.00000000 81.59250741 490.28221746  
Rotation angle (degrees) 1.16887543  
Shift along axis -0.85707851  
  

> show #!6 models

> hide #!3 models

> show #!15 models

> hide #!14 models

> fitmap #15 inMap #6

Fit molecule cast_b2 (#15) to map cast_04Bb2_3o27_20k_J1629_007_nus_mb20.ccp4
(#6) using 16478 atoms  
average map value = 0.05601, steps = 280  
shifted from previous position = 0.785  
rotated from previous position = 0.764 degrees  
atoms outside contour = 11840, contour level = 0.07  
  
Position of cast_b2 (#15) relative to
cast_04Bb2_3o27_20k_J1629_007_nus_mb20.ccp4 (#6) coordinates:  
Matrix rotation and translation  
0.99995797 0.00631761 -0.00664451 1.80657751  
-0.00630196 0.99997733 0.00237370 2.00470043  
0.00665935 -0.00233173 0.99997511 -2.04051772  
Axis -0.24855556 -0.70275080 -0.66660441  
Axis point 357.16425178 -0.00000000 251.01614627  
Rotation angle (degrees) 0.54234477  
Shift along axis -0.49762159  
  

> fitmap #15 inMap #6

Fit molecule cast_b2 (#15) to map cast_04Bb2_3o27_20k_J1629_007_nus_mb20.ccp4
(#6) using 16478 atoms  
average map value = 0.05601, steps = 404  
shifted from previous position = 0.0115  
rotated from previous position = 0.00809 degrees  
atoms outside contour = 11841, contour level = 0.07  
  
Position of cast_b2 (#15) relative to
cast_04Bb2_3o27_20k_J1629_007_nus_mb20.ccp4 (#6) coordinates:  
Matrix rotation and translation  
0.99995697 0.00645046 -0.00666733 1.76752561  
-0.00643447 0.99997638 0.00241690 2.04479333  
0.00668276 -0.00237389 0.99997485 -2.04284256  
Axis -0.25000995 -0.69668092 -0.67240667  
Axis point 356.19725860 0.00000000 244.32306123  
Rotation angle (degrees) 0.54897091  
Shift along axis -0.49284651  
  

> show #!16 models

> hide #!15 models

> show #!9 models

> hide #!6 models

> fitmap #16 inMap #9

Fit molecule cast_b3 (#16) to map cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4
(#9) using 16478 atoms  
average map value = 0.04434, steps = 64  
shifted from previous position = 0.868  
rotated from previous position = 0.661 degrees  
atoms outside contour = 12768, contour level = 0.06  
  
Position of cast_b3 (#16) relative to
cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4 (#9) coordinates:  
Matrix rotation and translation  
0.99998801 0.00470175 0.00137058 -2.19367853  
-0.00471260 0.99995672 0.00802163 -1.04617625  
-0.00133281 -0.00802799 0.99996689 2.52285784  
Axis -0.85359643 0.14377909 -0.50070021  
Axis point 0.00000000 342.29948763 140.49150161  
Rotation angle (degrees) 0.53865581  
Shift along axis 0.45890244  
  

> fitmap #16 inMap #9

Fit molecule cast_b3 (#16) to map cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4
(#9) using 16478 atoms  
average map value = 0.04434, steps = 48  
shifted from previous position = 0.017  
rotated from previous position = 0.0056 degrees  
atoms outside contour = 12761, contour level = 0.06  
  
Position of cast_b3 (#16) relative to
cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4 (#9) coordinates:  
Matrix rotation and translation  
0.99998836 0.00464790 0.00129755 -2.16308617  
-0.00465821 0.99995668 0.00805803 -1.07352143  
-0.00126004 -0.00806398 0.99996669 2.49367790  
Axis -0.85800998 0.13611450 -0.49526935  
Axis point 0.00000000 337.80566638 143.05960704  
Rotation angle (degrees) 0.53830211  
Shift along axis 0.47478546  
  

> fitmap #16 inMap #9

Fit molecule cast_b3 (#16) to map cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4
(#9) using 16478 atoms  
average map value = 0.04434, steps = 44  
shifted from previous position = 0.00808  
rotated from previous position = 0.00483 degrees  
atoms outside contour = 12760, contour level = 0.06  
  
Position of cast_b3 (#16) relative to
cast_04Bb3_3o53_19k_J1632_006_nus_mb20.ccp4 (#9) coordinates:  
Matrix rotation and translation  
0.99998839 0.00465140 0.00125880 -2.15209095  
-0.00466131 0.99995727 0.00798318 -1.05306286  
-0.00122162 -0.00798895 0.99996734 2.46382593  
Axis -0.85621085 0.13296664 -0.49922224  
Axis point 0.00000000 337.35917213 141.58792703  
Rotation angle (degrees) 0.53441801  
Shift along axis 0.47262470  
  

> save
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb123/lr4_fb123_01.cxs
> includeMaps true

> hide #!16 models

> hide #!9 models

> show #!14 models

> show #!1 models

> show #!3 models

> hide #!3 models

> show #!3 models

> show #!2 models

> hide #!1 models

> hide #!3 models

> show #!1 models

> show #!3 models

> mmaker #2 to #14 bring #1 pairing ss

Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb #2/2 to cast_b1 #14/2  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb #2/3 to cast_b1 #14/3  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb #2/4 to cast_b1 #14/4  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb #2/5 to cast_b1 #14/5  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb #2/6 to cast_b1 #14/6  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb #2/7 to cast_b1 #14/7  
Parameters  
---  
Chain pairing | ss  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | Nucleic  
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 cast_b1, chain 2 (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain 2 (#2), sequence alignment
score = 60  
Matchmaker cast_b1, chain 3 (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain 3 (#2), sequence alignment
score = 184  
Matchmaker cast_b1, chain 4 (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain 4 (#2), sequence alignment
score = 104  
Matchmaker cast_b1, chain 5 (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain 5 (#2), sequence alignment
score = 104  
Matchmaker cast_b1, chain 6 (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain 6 (#2), sequence alignment
score = 192  
Matchmaker cast_b1, chain 7 (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain 7 (#2), sequence alignment
score = 60  
Matchmaker cast_b1, chain R (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain R (#2), sequence alignment
score = 2593.5  
Matchmaker cast_b1, chain S (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain S (#2), sequence alignment
score = 2578.9  
Matchmaker cast_b1, chain T (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain T (#2), sequence alignment
score = 1548.3  
Matchmaker cast_b1, chain U (#14) with
lr4_fb1_3o21_17k_J1695_005_sls_mb20_r02.pdb, chain U (#2), sequence alignment
score = 1556.5  
RMSD between 1776 pruned atom pairs is 0.000 angstroms; (across all 1776
pairs: 0.000)  
  

> hide #!1 models

> hide #!3 models

> hide #!14 models

> hide #!2 models

> show #!15 models

> show #!4 models

> show #!5 models

> show #!6 models

> hide #!4 models

> hide #!6 models

> show #!4 models

> show #!6 models

> mmaker #5 to #15 bring #4 pairing ss

Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb #5/2 to cast_b2 #15/2  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb #5/3 to cast_b2 #15/3  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb #5/4 to cast_b2 #15/4  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb #5/5 to cast_b2 #15/5  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb #5/6 to cast_b2 #15/6  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb #5/7 to cast_b2 #15/7  
Parameters  
---  
Chain pairing | ss  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | Nucleic  
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 cast_b2, chain 2 (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain 2 (#5), sequence alignment
score = 60  
Matchmaker cast_b2, chain 3 (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain 3 (#5), sequence alignment
score = 184  
Matchmaker cast_b2, chain 4 (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain 4 (#5), sequence alignment
score = 104  
Matchmaker cast_b2, chain 5 (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain 5 (#5), sequence alignment
score = 104  
Matchmaker cast_b2, chain 6 (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain 6 (#5), sequence alignment
score = 192  
Matchmaker cast_b2, chain 7 (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain 7 (#5), sequence alignment
score = 60  
Matchmaker cast_b2, chain R (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain R (#5), sequence alignment
score = 2588.7  
Matchmaker cast_b2, chain S (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain S (#5), sequence alignment
score = 2572.9  
Matchmaker cast_b2, chain T (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain T (#5), sequence alignment
score = 1548.9  
Matchmaker cast_b2, chain U (#15) with
lr4_fb2_3o74_20k_J1693_006_sls_mb20_r02.pdb, chain U (#5), sequence alignment
score = 1551.7  
RMSD between 1776 pruned atom pairs is 0.000 angstroms; (across all 1776
pairs: 0.000)  
  

> hide #!4 models

> hide #!6 models

> hide #!15 models

> show #!4 models

> show #!6 models

> hide #!5 models

> show #!2 models

> hide #!2 models

> show #!1 models

> hide #!1 models

> hide #!4 models

> show #!4 models

> show #!5 models

> hide #!6 models

> hide #!4 models

> show #!15 models

> show #!14 models

> hide #!14 models

> hide #!15 models

> show #!16 models

> hide #!5 models

> show #!8 models

> show #!7 models

> show #!9 models

> hide #!9 models

> volume #7 level 0.08

> volume #7 level 0.06

> hide #!16 models

> volume #7 level 0.04

> volume #7 level 0.05

> show #!16 models

> hide #!7 models

> show #!7 models

> show #!9 models

> hide #!7 models

> show #!7 models

> mmaker #8 to #16 bring #7 pairing ss

Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb #8/2 to cast_b3 #16/2  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb #8/3 to cast_b3 #16/3  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb #8/4 to cast_b3 #16/4  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb #8/5 to cast_b3 #16/5  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb #8/6 to cast_b3 #16/6  
Using Nucleic matrix instead of BLOSUM-62 to match
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb #8/7 to cast_b3 #16/7  
Parameters  
---  
Chain pairing | ss  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | Nucleic  
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 cast_b3, chain 2 (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain 2 (#8), sequence alignment
score = 60  
Matchmaker cast_b3, chain 3 (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain 3 (#8), sequence alignment
score = 184  
Matchmaker cast_b3, chain 4 (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain 4 (#8), sequence alignment
score = 104  
Matchmaker cast_b3, chain 5 (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain 5 (#8), sequence alignment
score = 104  
Matchmaker cast_b3, chain 6 (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain 6 (#8), sequence alignment
score = 192  
Matchmaker cast_b3, chain 7 (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain 7 (#8), sequence alignment
score = 60  
Matchmaker cast_b3, chain R (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain R (#8), sequence alignment
score = 2591.7  
Matchmaker cast_b3, chain S (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain S (#8), sequence alignment
score = 2573.5  
Matchmaker cast_b3, chain T (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain T (#8), sequence alignment
score = 1544.7  
Matchmaker cast_b3, chain U (#16) with
lr4_fb3_4o00_19k_J1694_005_sls_mb20_r01.pdb, chain U (#8), sequence alignment
score = 1555.9  
RMSD between 1776 pruned atom pairs is 0.000 angstroms; (across all 1776
pairs: 0.000)  
  

> hide #!7 models

> hide #!9 models

> hide #!16 models

> show #!7 models

> hide #!8 models

> show #!9 models

> hide #!7 models

> show #!7 models

> hide #!7 models

> show #!7 models

> hide #!7 models

> show #!8 models

> hide #!9 models

> show #!16 models

> hide #!16 models

> show #!9 models

> show #!7 models

> hide #!8 models

> hide #!9 models

> hide #!7 models

> show #!1 models

> show #!2 models

> hide #!1 models

> show #!5 models

> show #!8 models

> hide #!8 models

> hide #!5 models

> hide #!2 models

> show #!1 models

> show #!3 models

> show #!4 models

> show #!6 models

> show #!7 models

> show #!9 models

> volume showOutlineBox true

> volume showOutlineBox false

> hide #!4 models

> hide #!6 models

> hide #!7 models

> hide #!9 models

> hide #!3 models

> show #!4 models

> show #!7 models

> color #4 yellow models

> save
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb123/lr4_fb123_01.cxs
> includeMaps true

> show #10 models

> show #!2 models

> hide #!1 models

> show #!5 models

> hide #!4 models

> show #!8 models

> hide #!7 models

> save
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb123/lr4_fb123_01.cxs
> includeMaps true

> save
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb123/lr4_fb123_02s.cxs
> includeMaps true

> hide #!4 models

> close #11-13#14-16

> rename #10 L5_TnsC

> rename #1 lr4_fb1_3o21_17k_locref_sharp

> rename #2 lr4_fb1_r02

> rename #3 cast_04Bb1_3o23_17k_nu_sharp

> rename #4 lr4_fb2_3o74_20k_locref_sharp

> rename #1 lr4_fb1_3o21_17k_locref_sh

> rename #3 cast_04Bb1_3o23_17k_nu_sh

> rename #4 lr4_fb2_3o74_20k_locref_sh

> rename #1 map_b1_lr4_fb1_3o21_17k_locref_sh

> rename #2 mod_b1_lr4_fb1_r02

> rename #3 map_b1_cast_04Bb1_3o23_17k_nu_sh

> rename #4 map_b2_lr4_fb2_3o74_20k_locref_sh

> rename #5 mod_b2_lr4_fb2_r02

> rename #6 map_b2_cast_04Bb2_3o27_20k_nus_sh

> rename #7 map_b3_lr4_fb3_4o00_19k_locref_sh

> rename #8 mod_b3_lr4_fb3_r01

> rename #9 map_b3_cast_04Bb3_3o53_19k_nu_sh

> show #!1 models

> show #!3 models

> hide #!5 models

> hide #!8 models

> hide #10 models

> show #!4 models

> hide #!3 models

> hide #!2 models

> hide #!1 models

> hide #!4 models

> show #!1 models

> show #!2 models

> hide #!2 models

> show #!3 models

> color #1 #c6c6c6ff models

> color #3 #c6c6c6ff models

> color #3 #919191ff models

> color #3 #7e7e7eff models

> hide #!1 models

> show #!1 models

> volume #1 level 0.12

> hide #!3 models

> volume #1 level 0.1

> show #!2 models

> show #!3 models

> hide #!2 models

> hide #!1 models

> hide #!3 models

> show #!4 models

> color #4 #0096ffff models

> show #!5 models

> hide #!4 models

> color #6 #0096ffff models

> color #6 blue models

> show #!4 models

> show #!6 models

> hide #!4 models

> hide #!6 models

> show #!2 models

> show #!8 models

> show #!1 models

> hide #!2 models

> show #!4 models

> hide #!5 models

> show #!7 models

> hide #!8 models

> show #!6 models

> hide #!4 models

> show #!3 models

> hide #!6 models

> hide #!7 models

> show #!4 models

> hide #!3 models

> hide #!1 models

> show #!6 models

> hide #!6 models

> show #!6 models

> color #6 #aa00ffff models

> color #6 #0055ffff models

> color #6 #aa55ffff models

> color #6 #0055ffff models

> color #6 #aa00ffff models

> color #6 #0055ffff models

> hide #!6 models

> hide #!4 models

> show #!7 models

> show #!9 models

> color #7 #ffaa00ff models

> color #9 #ffaa00ff models

> color #9 #cc8800ff models

> color #9 #ff5500ff models

> color #9 red models

> hide #!7 models

> show #!6 models

> show #!3 models

> show #!7 models

> hide #!6 models

> hide #!3 models

> show #!5 models

> hide #!5 models

> hide #!9 models

> show #!4 models

> show #!1 models

> show #!2 models

> hide #!1 models

> hide #!4 models

> show #!5 models

> hide #!7 models

> show #!8 models

> show #10 models

> save
> D:/Docs/phenix_projects/cast/locref4L/lr4_cast_locref/lr4_fb123/lr4_fb123_02s.cxs
> includeMaps true

——— End of log from Mon Jul 31 20:30:42 2023 ———

opened ChimeraX session  

> combine #2 name b1_fitR

> combine #5 name b2_fitR

> hide #!8 models

> show #!8 models

> combine #8 name b3_fitR

> hide #!2 models

> hide #!5 models

> hide #!8 models

> hide #10 models

> hide #!12 models

> hide #!13 models

> show #!13 models

> show #!12 models

> select #11-13/R

12138 atoms, 12342 bonds, 3 pseudobonds, 1515 residues, 6 models selected  

> hide #!12 models

> hide #!13 models

> select #11-13/R:182-999999

8502 atoms, 8652 bonds, 3 pseudobonds, 1062 residues, 6 models selected  

> show #!12 models

> show #!13 models

> ui tool show Matchmaker

> matchmaker #!12-13 & sel to #11 & sel

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 b1_fitR, chain R (#11) with b2_fitR, chain R (#12), sequence
alignment score = 1764.8  
RMSD between 342 pruned atom pairs is 0.771 angstroms; (across all 353 pairs:
0.949)  
  
Matchmaker b1_fitR, chain R (#11) with b3_fitR, chain R (#13), sequence
alignment score = 1730.6  
RMSD between 331 pruned atom pairs is 0.814 angstroms; (across all 353 pairs:
1.048)  
  

> hide #!12 models

> show #!12 models

> hide #!13 models

> show #!13 models

> hide #!12 models

> hide #!11 models

> show #!11 models

> show #!12 models

> hide #!11 models

> select #11-13/R:411-999999

2988 atoms, 3006 bonds, 3 pseudobonds, 375 residues, 6 models selected  

> ui tool show Matchmaker

> show #!11 models

> matchmaker #!12-13 & sel to #11 & sel

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 b1_fitR, chain R (#11) with b2_fitR, chain R (#12), sequence
alignment score = 584.7  
RMSD between 117 pruned atom pairs is 0.952 angstroms; (across all 124 pairs:
1.248)  
  
Matchmaker b1_fitR, chain R (#11) with b3_fitR, chain R (#13), sequence
alignment score = 582.9  
RMSD between 107 pruned atom pairs is 0.869 angstroms; (across all 124 pairs:
1.357)  
  

> hide #!12 models

> hide #!13 models

> show #!13 models

> show #!12 models

> hide #!11 models

> show #!11 models

> select #11-13/R:411-501

2196 atoms, 2220 bonds, 273 residues, 3 models selected  

> ui tool show Matchmaker

> matchmaker #!12-13 & sel to #11 & sel

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 b1_fitR, chain R (#11) with b2_fitR, chain R (#12), sequence
alignment score = 429.5  
RMSD between 85 pruned atom pairs is 0.851 angstroms; (across all 91 pairs:
1.073)  
  
Matchmaker b1_fitR, chain R (#11) with b3_fitR, chain R (#13), sequence
alignment score = 439.1  
RMSD between 87 pruned atom pairs is 0.845 angstroms; (across all 91 pairs:
0.985)  
  

> rename #11 b1_fitR411-501

> rename #12 b2_fitR411-501

> rename #13 b3_fitR411-501

> hide #!12 models

> hide #!13 models

> show #!12 models

> show #!13 models

> hide #!11 models

> hide #!12 models

> hide #!13 models

> select clear

> show #!2 models

> show #!5 models

> show #!8 models

> show #10 models

> show #!11 models

> show #!12 models

> hide #!8 models

> hide #!5 models

> hide #10 models

> show #!5 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> show #!8 models

> hide #!8 models

> show #!8 models

> hide #!5 models

> hide #!2 models

> hide #!11 models

> hide #!12 models

> show #!2 models

> hide #!2 models

> show #!2 models

> hide #!2 models

> show #!2 models

> hide #!2 models

> show #!5 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> show #!2 models

> hide #!2 models

> show #!2 models

> hide #!5 models

> show #!5 models

> hide #!5 models

> show #!5 models

> show #10 models

> hide #!2 models

> hide #!5 models

> hide #!8 models

> show #!11 models

> show #!12 models

> show #!13 models

> hide #10 models

> show #!2 models

> show #!5 models

> show #!8 models

> hide #!11 models

> hide #!12 models

> hide #!13 models

> show #10 models

> show #!1 models

> show #!3 models

> hide #!2 models

> hide #!3 models

> hide #!1 models

> show #!2 models

> save /Users/pmesa/Desktop/lr4_fb123/lr4_fb123_02s.cxs includeMaps true

——— End of log from Tue Aug 1 12:56:49 2023 ———

opened ChimeraX session  

> open /Users/jng994/Desktop/paborra/L5_allmaps_locrefcomp_02s.cxs

Unable to restore session, resetting.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/session.py", line 700, in restore  
self.reset()  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/session.py", line 541, in reset  
sm.reset_state(container, self)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/bond_rot/manager.py", line 149, in reset_state  
self.clear()  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/bond_rot/manager.py", line 45, in delete_all_rotations  
for rotater in self.bond_rotaters.values():  
AttributeError: 'list' object has no attribute 'values'  
  

Failed opening file
/Users/jng994/Desktop/paborra/L5_allmaps_locrefcomp_02s.cxs:  
'list' object has no attribute 'values'  

> open /Users/jng994/Desktop/paborra/L5_allmaps_locrefcomp_02s.cxs

Unable to restore session, resetting.  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/session.py", line 700, in restore  
self.reset()  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/session.py", line 541, in reset  
sm.reset_state(container, self)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/bond_rot/manager.py", line 149, in reset_state  
self.clear()  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/bond_rot/manager.py", line 45, in delete_all_rotations  
for rotater in self.bond_rotaters.values():  
AttributeError: 'list' object has no attribute 'values'  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/session.py", line 700, in restore  
self.reset()  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/session.py", line 541, in reset  
sm.reset_state(container, self)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/bond_rot/manager.py", line 149, in reset_state  
self.clear()  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/bond_rot/manager.py", line 45, in delete_all_rotations  
for rotater in self.bond_rotaters.values():  
AttributeError: 'list' object has no attribute 'values'  
  
During handling of the above exception, another exception occurred:  
  
Traceback (most recent call last):  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/open_command/dialog.py", line 162, in _qt_safe  
run(session, "open " + " ".join([FileNameArg.unparse(p) for p in paths]) + (""  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/commands/run.py", line 38, in run  
results = command.run(text, log=log, return_json=return_json)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/commands/cli.py", line 2897, in run  
result = ci.function(session, **kw_args)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/open_command/cmd.py", line 118, in cmd_open  
models = Command(session, registry=registry).run(provider_cmd_text,
log=log)[0]  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/commands/cli.py", line 2897, in run  
result = ci.function(session, **kw_args)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/open_command/cmd.py", line 193, in provider_open  
models, status = collated_open(session, None, [data], data_format,
_add_models,  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/open_command/cmd.py", line 458, in collated_open  
return remember_data_format()  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/open_command/cmd.py", line 428, in remember_data_format  
models, status = func(*func_args, **func_kw)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core_formats/__init__.py", line 26, in open  
return cxs_open(session, data, **kw)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/session.py", line 1004, in open  
session.restore(stream, path=path, resize_window=resize_window)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/session.py", line 742, in restore  
self.reset()  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/core/session.py", line 541, in reset  
sm.reset_state(container, self)  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/bond_rot/manager.py", line 149, in reset_state  
self.clear()  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/bond_rot/manager.py", line 45, in delete_all_rotations  
for rotater in self.bond_rotaters.values():  
AttributeError: 'list' object has no attribute 'values'  
  
AttributeError: 'list' object has no attribute 'values'  
  
File
"/Applications/ChimeraX-1.5.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-
packages/chimerax/bond_rot/manager.py", line 45, in delete_all_rotations  
for rotater in self.bond_rotaters.values():  
  
See log for complete Python traceback.  
  




OpenGL version: 4.1 ATI-4.12.7
OpenGL renderer: AMD Radeon Pro 5300M OpenGL Engine
OpenGL vendor: ATI Technologies Inc.

Python: 3.9.11
Locale: UTF-8
Qt version: PyQt6 6.3.1, Qt 6.3.1
Qt runtime version: 6.3.2
Qt platform: cocoa
Hardware:

    Hardware Overview:

      Model Name: MacBook Pro
      Model Identifier: MacBookPro16,1
      Processor Name: 6-Core Intel Core i7
      Processor Speed: 2.6 GHz
      Number of Processors: 1
      Total Number of Cores: 6
      L2 Cache (per Core): 256 KB
      L3 Cache: 12 MB
      Hyper-Threading Technology: Enabled
      Memory: 16 GB
      System Firmware Version: 1968.120.12.0.0 (iBridge: 20.16.5060.0.0,0)
      OS Loader Version: 577~170

Software:

    System Software Overview:

      System Version: macOS 13.4.1 (c) (22F770820d)
      Kernel Version: Darwin 22.5.0
      Time since boot: 19 days, 4 hours, 29 minutes

Graphics/Displays:

    Intel UHD Graphics 630:

      Chipset Model: Intel UHD Graphics 630
      Type: GPU
      Bus: Built-In
      VRAM (Dynamic, Max): 1536 MB
      Vendor: Intel
      Device ID: 0x3e9b
      Revision ID: 0x0000
      Automatic Graphics Switching: Supported
      gMux Version: 5.0.0
      Metal Support: Metal 3

    AMD Radeon Pro 5300M:

      Chipset Model: AMD Radeon Pro 5300M
      Type: GPU
      Bus: PCIe
      PCIe Lane Width: x16
      VRAM (Total): 4 GB
      Vendor: AMD (0x1002)
      Device ID: 0x7340
      Revision ID: 0x0043
      ROM Revision: 113-D3220E-190
      VBIOS Version: 113-D32207P1-019
      Option ROM Version: 113-D32207P1-019
      EFI Driver Version: 01.A1.190
      Automatic Graphics Switching: Supported
      gMux Version: 5.0.0
      Metal Support: Metal 3
      Displays:
        Color LCD:
          Display Type: Built-In Retina LCD
          Resolution: 3072 x 1920 Retina
          Framebuffer Depth: 24-Bit Color (ARGB8888)
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Automatically Adjust Brightness: Yes
          Connection Type: Internal


Installed Packages:
    alabaster: 0.7.12
    appdirs: 1.4.4
    appnope: 0.1.3
    asttokens: 2.1.0
    Babel: 2.11.0
    backcall: 0.2.0
    blockdiag: 3.0.0
    build: 0.8.0
    certifi: 2021.10.8
    cftime: 1.6.2
    charset-normalizer: 2.1.1
    ChimeraX-AddCharge: 1.4
    ChimeraX-AddH: 2.2.1
    ChimeraX-AlignmentAlgorithms: 2.0
    ChimeraX-AlignmentHdrs: 3.2.1
    ChimeraX-AlignmentMatrices: 2.0
    ChimeraX-Alignments: 2.6
    ChimeraX-AlphaFold: 1.0
    ChimeraX-AltlocExplorer: 1.0.3
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Arrays: 1.0
    ChimeraX-Atomic: 1.41.5
    ChimeraX-AtomicLibrary: 8.0.3
    ChimeraX-AtomSearch: 2.0.1
    ChimeraX-AxesPlanes: 2.3
    ChimeraX-BasicActions: 1.1.2
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 2.1.2
    ChimeraX-BondRot: 2.0.1
    ChimeraX-BugReporter: 1.0.1
    ChimeraX-BuildStructure: 2.7.1
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.2
    ChimeraX-ButtonPanel: 1.0.1
    ChimeraX-CageBuilder: 1.0.1
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.3.1
    ChimeraX-ChangeChains: 1.0.2
    ChimeraX-CheckWaters: 1.3
    ChimeraX-ChemGroup: 2.0
    ChimeraX-Clashes: 2.2.4
    ChimeraX-ColorActions: 1.0.3
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.5.2
    ChimeraX-CommandLine: 1.2.4
    ChimeraX-ConnectStructure: 2.0.1
    ChimeraX-Contacts: 1.0.1
    ChimeraX-Core: 1.5
    ChimeraX-CoreFormats: 1.1
    ChimeraX-coulombic: 1.3.2
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
    ChimeraX-CrystalContacts: 1.0.1
    ChimeraX-DataFormats: 1.2.2
    ChimeraX-Dicom: 1.1
    ChimeraX-DistMonitor: 1.3
    ChimeraX-DockPrep: 1.0
    ChimeraX-Dssp: 2.0
    ChimeraX-EMDB-SFF: 1.0
    ChimeraX-ExperimentalCommands: 1.0
    ChimeraX-FileHistory: 1.0.1
    ChimeraX-FunctionKey: 1.0.1
    ChimeraX-Geometry: 1.2
    ChimeraX-gltf: 1.0
    ChimeraX-Graphics: 1.1
    ChimeraX-Hbonds: 2.4
    ChimeraX-Help: 1.2.1
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.1
    ChimeraX-ImageFormats: 1.2
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.1
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-Label: 1.1.7
    ChimeraX-ListInfo: 1.1.1
    ChimeraX-Log: 1.1.5
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.8.2
    ChimeraX-Map: 1.1.2
    ChimeraX-MapData: 2.0
    ChimeraX-MapEraser: 1.0.1
    ChimeraX-MapFilter: 2.0
    ChimeraX-MapFit: 2.0
    ChimeraX-MapSeries: 2.1.1
    ChimeraX-Markers: 1.0.1
    ChimeraX-Mask: 1.0.1
    ChimeraX-MatchMaker: 2.0.9
    ChimeraX-MDcrds: 2.6
    ChimeraX-MedicalToolbar: 1.0.2
    ChimeraX-Meeting: 1.0.1
    ChimeraX-MLP: 1.1
    ChimeraX-mmCIF: 2.8
    ChimeraX-MMTF: 2.2
    ChimeraX-Modeller: 1.5.6
    ChimeraX-ModelPanel: 1.3.6
    ChimeraX-ModelSeries: 1.0.1
    ChimeraX-Mol2: 2.0
    ChimeraX-Mole: 1.0
    ChimeraX-Morph: 1.0.1
    ChimeraX-MouseModes: 1.1.1
    ChimeraX-Movie: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nucleotides: 2.0.3
    ChimeraX-OpenCommand: 1.9.1
    ChimeraX-PDB: 2.6.8
    ChimeraX-PDBBio: 1.0
    ChimeraX-PDBLibrary: 1.0.2
    ChimeraX-PDBMatrices: 1.0
    ChimeraX-PickBlobs: 1.0.1
    ChimeraX-Positions: 1.0
    ChimeraX-PresetMgr: 1.1
    ChimeraX-PubChem: 2.1
    ChimeraX-ReadPbonds: 1.0.1
    ChimeraX-Registration: 1.1.1
    ChimeraX-RemoteControl: 1.0
    ChimeraX-RenumberResidues: 1.1
    ChimeraX-ResidueFit: 1.0.1
    ChimeraX-RestServer: 1.1
    ChimeraX-RNALayout: 1.0
    ChimeraX-RotamerLibMgr: 2.0.1
    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
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0
    ChimeraX-SelInspector: 1.0
    ChimeraX-SeqView: 2.7.2
    ChimeraX-Shape: 1.0.1
    ChimeraX-Shell: 1.0.1
    ChimeraX-Shortcuts: 1.1.1
    ChimeraX-ShowSequences: 1.0.1
    ChimeraX-SideView: 1.0.1
    ChimeraX-Smiles: 2.1
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.10
    ChimeraX-STL: 1.0
    ChimeraX-Storm: 1.0
    ChimeraX-StructMeasure: 1.1
    ChimeraX-Struts: 1.0.1
    ChimeraX-Surface: 1.0
    ChimeraX-SwapAA: 2.0.1
    ChimeraX-SwapRes: 2.1.3
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.1.2
    ChimeraX-ToolshedUtils: 1.2.1
    ChimeraX-Tug: 1.0.1
    ChimeraX-UI: 1.24.3
    ChimeraX-uniprot: 2.2.1
    ChimeraX-UnitCell: 1.0.1
    ChimeraX-ViewDockX: 1.1.4
    ChimeraX-VIPERdb: 1.0
    ChimeraX-Vive: 1.1
    ChimeraX-VolumeMenu: 1.0.1
    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0.1
    ChimeraX-WebServices: 1.1.0
    ChimeraX-Zone: 1.0.1
    colorama: 0.4.5
    cxservices: 1.2
    cycler: 0.11.0
    Cython: 0.29.32
    debugpy: 1.6.4
    decorator: 5.1.1
    docutils: 0.19
    entrypoints: 0.4
    executing: 1.2.0
    filelock: 3.7.1
    fonttools: 4.38.0
    funcparserlib: 1.0.1
    grako: 3.16.5
    h5py: 3.7.0
    html2text: 2020.1.16
    idna: 3.4
    ihm: 0.33
    imagecodecs: 2022.7.31
    imagesize: 1.4.1
    importlib-metadata: 5.1.0
    ipykernel: 6.15.3
    ipython: 8.4.0
    ipython-genutils: 0.2.0
    jedi: 0.18.1
    Jinja2: 3.1.2
    jupyter-client: 7.3.4
    jupyter-core: 5.1.0
    kiwisolver: 1.4.4
    line-profiler: 3.5.1
    lxml: 4.9.1
    lz4: 4.0.2
    MarkupSafe: 2.1.1
    matplotlib: 3.5.2
    matplotlib-inline: 0.1.6
    msgpack: 1.0.4
    nest-asyncio: 1.5.6
    netCDF4: 1.6.0
    networkx: 2.8.5
    numexpr: 2.8.4
    numpy: 1.23.1
    openvr: 1.23.701
    packaging: 21.3
    ParmEd: 3.4.3
    parso: 0.8.3
    pep517: 0.13.0
    pexpect: 4.8.0
    pickleshare: 0.7.5
    Pillow: 9.2.0
    pip: 22.2.2
    pkginfo: 1.8.3
    platformdirs: 2.5.4
    prompt-toolkit: 3.0.33
    psutil: 5.9.1
    ptyprocess: 0.7.0
    pure-eval: 0.2.2
    pycollada: 0.7.2
    pydicom: 2.3.0
    Pygments: 2.12.0
    PyOpenGL: 3.1.5
    PyOpenGL-accelerate: 3.1.5
    pyparsing: 3.0.9
    PyQt6-commercial: 6.3.1
    PyQt6-Qt6: 6.3.2
    PyQt6-sip: 13.4.0
    PyQt6-WebEngine-commercial: 6.3.1
    PyQt6-WebEngine-Qt6: 6.3.2
    python-dateutil: 2.8.2
    pytz: 2022.6
    pyzmq: 24.0.1
    qtconsole: 5.3.1
    QtPy: 2.3.0
    RandomWords: 0.4.0
    requests: 2.28.1
    scipy: 1.9.0
    setuptools: 65.1.1
    setuptools-scm: 7.0.5
    sfftk-rw: 0.7.2
    six: 1.16.0
    snowballstemmer: 2.2.0
    sortedcontainers: 2.4.0
    Sphinx: 5.1.1
    sphinx-autodoc-typehints: 1.19.1
    sphinxcontrib-applehelp: 1.0.2
    sphinxcontrib-blockdiag: 3.0.0
    sphinxcontrib-devhelp: 1.0.2
    sphinxcontrib-htmlhelp: 2.0.0
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 1.0.3
    sphinxcontrib-serializinghtml: 1.1.5
    stack-data: 0.6.2
    tables: 3.7.0
    tifffile: 2022.7.31
    tinyarray: 1.2.4
    tomli: 2.0.1
    tornado: 6.2
    traitlets: 5.3.0
    typing-extensions: 4.4.0
    urllib3: 1.26.13
    wcwidth: 0.2.5
    webcolors: 1.12
    wheel: 0.37.1
    wheel-filename: 1.4.1
    zipp: 3.11.0

Change History (2)

comment:1 by pett, 2 years ago

Component: UnassignedSessions
Owner: set to pett
Platform: all
Project: ChimeraX
Status: newaccepted
Summary: ChimeraX bug report submissionRestore new session in old ChimeraX

comment:2 by pett, 2 years ago

Resolution: limitation
Status: acceptedclosed
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