Opened 3 years ago
Closed 3 years ago
#6885 closed defect (duplicate)
MatchMaker: wrapped C/C++ object of type ChainMenuButton has been deleted
| Reported by: | Owned by: | Eric Pettersen | |
|---|---|---|---|
| Priority: | normal | Milestone: | |
| Component: | Structure Comparison | Version: | |
| Keywords: | Cc: | ||
| Blocked By: | Blocking: | ||
| Notify when closed: | Platform: | all | |
| Project: | ChimeraX |
Description
The following bug report has been submitted:
Platform: Linux-5.4.115-1.el8.elrepo.x86_64-x86_64-with-glibc2.14
ChimeraX Version: 1.2 (2021-04-27 05:33:30 UTC)
Description
(Describe the actions that caused this problem to occur here)
Log:
UCSF ChimeraX version: 1.2 (2021-04-27)
© 2016-2021 Regents of the University of California. All rights reserved.
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/SSU/rps3_chaiN_C.cxs
> format session
Log from Tue May 17 14:49:39 2022UCSF ChimeraX version: 1.2 (2021-04-27)
© 2016-2021 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
> open
> /yonath_group/sarit/pg_W83/RealSpaceRefine_26/50S_new_map_combined_WITH_MOD_2_3_real_space_refined_real_space_refined_026.pdb
> format pdb
Chain information for
50S_new_map_combined_WITH_MOD_2_3_real_space_refined_real_space_refined_026.pdb
#1
---
Chain | Description
0 | No description available
1 | No description available
2 | No description available
4 | No description available
5 | No description available
6 | No description available
7 | No description available
8 | No description available
A | No description available
B | No description available
D | No description available
E | No description available
F | No description available
M | No description available
N | No description available
O | No description available
P | No description available
Q | No description available
R | No description available
S | No description available
T | No description available
U | No description available
V | No description available
W | No description available
X | No description available
Y | No description available
Z | No description available
h | No description available
> set bgColor white
> open /yonath_group/disha/Gingivalis/multimaps_new/50S_map.mrc
Opened 50S_map.mrc as #2, grid size 460,460,460, pixel 0.86, shown at level
0.00952, step 2, values float32
> select #1
75706 atoms, 81315 bonds, 80 pseudobonds, 6308 residues, 2 models selected
> show sel atoms
> nucleotides sel atoms
> style nucleic & sel stick
Changed 53096 atom styles
> style sel stick
Changed 75706 atom styles
> volume style mesh
> volume #2 step 1
> volume #2 level 0.02
> select #1/A: 556-570
260 atoms, 290 bonds, 2 pseudobonds, 12 residues, 2 models selected
> select
75706 atoms, 81315 bonds, 80 pseudobonds, 6308 residues, 4 models selected
> select #1/A: 556-570
260 atoms, 290 bonds, 2 pseudobonds, 12 residues, 2 models selected
> select ~sel
75446 atoms, 81025 bonds, 78 pseudobonds, 6296 residues, 4 models selected
> hide sel atoms
> ui tool show "Surface Zone"
> surface zone #2 nearAtoms sel distance 5.12
> surface zone #2 nearAtoms sel distance 5.12
> surface zone #2 nearAtoms sel distance 5.12
> select clear
> select #1/A: 556-570
260 atoms, 290 bonds, 2 pseudobonds, 12 residues, 2 models selected
> surface zone #2 nearAtoms sel distance 5.12
> surface zone #2 nearAtoms sel distance 5.12
> surface zone #2 nearAtoms sel distance 3.6
> volume step 1
> volume step 1
> volume step 2
> volume step 1
> volume step 1 subdivideSurface true
> volume step 1 subdivideSurface true
> \
Unknown command: \
> \
Unknown command: \
> select #1/A: 556-570
260 atoms, 290 bonds, 2 pseudobonds, 12 residues, 2 models selected
> surface zone #2 nearAtoms sel distance 3.6
> surface zone #2 nearAtoms sel distance 3.6
> select #1/A: 556-570
260 atoms, 290 bonds, 2 pseudobonds, 12 residues, 2 models selected
> select ~sel
75446 atoms, 81025 bonds, 78 pseudobonds, 6296 residues, 4 models selected
> show sel atoms
> hide sel atoms
No atoms selected for zoning
> volume step 1 subdivideSurface true
> select #1/A: 556-570
260 atoms, 290 bonds, 2 pseudobonds, 12 residues, 2 models selected
> color sel byhetero
> ui tool show "Color Actions"
> ui tool show "Color Actions"
> color #1/A: 556-570 royal blue
> color sel byhetero
> color sel bypolymer
> select clear
> graphics silhouettes true
> graphics silhouettes false
> hide #!2 models
> graphics silhouettes true
> show #!2 models
> volume step 1 subdivideSurface false
> close session
> open
> /yonath_group/disha/Gingivalis/delta266/models/final_models/merged_FR_30S_D266_real_space_refined-
> coot-4.pdb
Chain information for merged_FR_30S_D266_real_space_refined-coot-4.pdb #1
---
Chain | Description
C | No description available
D | No description available
E | No description available
F | No description available
G | No description available
H | No description available
I | No description available
J | No description available
K | No description available
L | No description available
M | No description available
N | No description available
O | No description available
P | No description available
Q | No description available
R | No description available
T | No description available
a | No description available
o | No description available
> show cartoons
> hide atoms
> graphics silhouettes false
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/7k00_aligned_d266_30s.pdb
Chain information for 7k00_aligned_d266_30s.pdb #2
---
Chain | Description
0 | No description available
1 | No description available
2 | No description available
3 | No description available
4 | No description available
5 | No description available
A | No description available
B | No description available
C | No description available
D | No description available
E | No description available
F | No description available
G | No description available
H | No description available
I | No description available
J | No description available
K | No description available
L | No description available
M | No description available
N | No description available
O | No description available
P | No description available
Q | No description available
R | No description available
S | No description available
T | No description available
U | No description available
X | No description available
Y | No description available
Z | No description available
a | No description available
b | No description available
c | No description available
d | No description available
e | No description available
f | No description available
g | No description available
h | No description available
i | No description available
j | No description available
k | No description available
l | No description available
m | No description available
n | No description available
o | No description available
p | No description available
q | No description available
r | No description available
s | No description available
t | No description available
u | No description available
v | No description available
w | No description available
x | No description available
y | No description available
z | No description available
> select #2
149338 atoms, 154090 bonds, 1515 pseudobonds, 17719 residues, 3 models
selected
> hide sel atoms
> show sel cartoons
> sequence chain #2/Z
Alignment identifier is 2/Z
> sequence chain #2/0
Alignment identifier is 2/0
> close session
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/RNA/23s_merged_FR_30S_D266_real_space_refined-
> coot-5.pdb
Chain information for 23s_merged_FR_30S_D266_real_space_refined-coot-5.pdb #1
---
Chain | Description
a | No description available
> hide cartoons
> show cartoons
> hide atoms
> lighting shadows true
> lighting shadows false
> lighting simple
> select #1
29556 atoms, 32860 bonds, 34 pseudobonds, 1564 residues, 2 models selected
> ui tool show "Color Actions"
> ui tool show "Color Actions"
> color sel royal blue
> color sel royal blue
> select clear
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/RNA/23S_7k00_aligned_d266_30s-coot-0.pdb
Chain information for 23S_7k00_aligned_d266_30s-coot-0.pdb #2
---
Chain | Description
A | No description available
> hide atoms
> select #2
34830 atoms, 36578 bonds, 4 pseudobonds, 3678 residues, 2 models selected
> color sel sea green
> color sel dark orange
> select clear
> close session
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/RNA/16S_merged_FR_30S_D266_real_space_refined-
> coot-5.pdb
Chain information for 16S_merged_FR_30S_D266_real_space_refined-coot-5.pdb #1
---
Chain | Description
a | No description available
> select clear
> hide atoms
> color royal blue
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/RNA/16S_7k00_aligned_d266_30s-coot-0.pdb
Chain information for 16S_7k00_aligned_d266_30s-coot-0.pdb #2
---
Chain | Description
A | No description available
> hide atoms
> select #2
34830 atoms, 36578 bonds, 4 pseudobonds, 3678 residues, 2 models selected
> color sel dark orange
> select clear
> select clear
> select #1/a:204
20 atoms, 21 bonds, 1 residue, 1 model selected
> color sel dim gray
> ui tool show Matchmaker
> matchmaker #!2 to #1 matrix Nucleic
Parameters
---
Chain pairing | bb
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 16S_merged_FR_30S_D266_real_space_refined-coot-5.pdb, chain a (#1)
with 16S_7k00_aligned_d266_30s-coot-0.pdb, chain A (#2), sequence alignment
score = 3392.4
RMSD between 605 pruned atom pairs is 1.339 angstroms; (across all 1350 pairs:
12.255)
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/RNA/16S_4w2e_aligned_d266_30s-coot-0.pdb
Chain information for 16S_4w2e_aligned_d266_30s-coot-0.pdb #3
---
Chain | Description
a | No description available
> color sel rosy brown
> select #3
32517 atoms, 36002 bonds, 4 pseudobonds, 1850 residues, 2 models selected
> color sel rosy brown
> color sel dark olive green
> hide sel atoms
> undo
> hide sel atoms
> hide #!2 models
> hide #!3 models
> select #1/a: 1479-1485
133 atoms, 149 bonds, 6 residues, 1 model selected
> select ~sel
96770 atoms, 105291 bonds, 42 pseudobonds, 7086 residues, 6 models selected
> hide sel & #!1 cartoons
> select #1/a: 1479-1485
133 atoms, 149 bonds, 6 residues, 1 model selected
> hide sel atoms
> show sel atoms
> nucleotides sel atoms
> style nucleic & sel stick
Changed 133 atom styles
> open
> /yonath_group/disha/Gingivalis/delta266/maps/3s_head_body_combined_aligned_shiny.mrc
Opened 3s_head_body_combined_aligned_shiny.mrc as #4, grid size 450,444,450,
pixel 0.852,0.852,0.852, shown at level 0.00558, step 2, values float32
> volume #4 step 1
> volume #4 level 0.02
> volume step 2
> volume style mesh
> volume #4 color black
> volume #4 color #cacaca
> select #1/a: 1479-1485
133 atoms, 149 bonds, 6 residues, 1 model selected
> ui tool show "Surface Zone"
> surface zone #4 nearAtoms sel distance 5.11
> surface zone #4 nearAtoms sel distance 10.67
> close #1
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/RNA/16S_merged_FR_30S_D266_real_space_refined-
> coot-5.pdb
Chain information for 16S_merged_FR_30S_D266_real_space_refined-coot-5.pdb #1
---
Chain | Description
a | No description available
> hide #!1 atoms
> select #1
29556 atoms, 32860 bonds, 34 pseudobonds, 1564 residues, 2 models selected
> hide sel cartoons
> select #1/a: 1479-1485
133 atoms, 149 bonds, 6 residues, 1 model selected
> show sel cartoons
> show sel atoms
> nucleotides sel atoms
> style nucleic & sel stick
Changed 133 atom styles
> surface zone #4 nearAtoms sel distance 6.46
> open
> /yonath_group/disha/Gingivalis/delta266/models/final_models/merged_FR_30S_D266_real_space_refined-
> coot-4.pdb
Chain information for merged_FR_30S_D266_real_space_refined-coot-4.pdb #5
---
Chain | Description
C | No description available
D | No description available
E | No description available
F | No description available
G | No description available
H | No description available
I | No description available
J | No description available
K | No description available
L | No description available
M | No description available
N | No description available
O | No description available
P | No description available
Q | No description available
R | No description available
T | No description available
a | No description available
o | No description available
> hide sel atoms
> select #5
44960 atoms, 48441 bonds, 56 pseudobonds, 3595 residues, 2 models selected
> hide sel atoms
> select #5/a: 1479-1485
133 atoms, 149 bonds, 6 residues, 1 model selected
> show sel cartoons
> show sel cartoons
> show sel cartoons
> show sel atoms
> show sel surfaces
> hide sel surfaces
> show sel atoms
> show sel atoms
> hide sel atoms
> show sel atoms
> nucleotides sel atoms
> style nucleic & sel stick
Changed 133 atom styles
> volume #4 step 1
> volume #4 level 0.02056
> volume #4 level 0.003504
> select #5/a: 1479-1485
133 atoms, 149 bonds, 6 residues, 1 model selected
> surface zone #4 nearAtoms sel distance 6.46
> surface zone #4 nearAtoms sel distance 6.46
> surface zone #4 nearAtoms sel distance 6.46
> surface zone #4 nearAtoms sel distance 6.46
> surface zone #4 nearAtoms sel distance 1.65
> volume step 1 subdivideSurface true
> surface zone #4 nearAtoms sel distance 2.12
> surface zone #4 nearAtoms sel distance 1.81
> close session
> open
> /yonath_group/disha/Gingivalis/delta266/models/final_models/merged_FR_30S_D266_real_space_refined-
> coot-4.pdb
Chain information for merged_FR_30S_D266_real_space_refined-coot-4.pdb #1
---
Chain | Description
C | No description available
D | No description available
E | No description available
F | No description available
G | No description available
H | No description available
I | No description available
J | No description available
K | No description available
L | No description available
M | No description available
N | No description available
O | No description available
P | No description available
Q | No description available
R | No description available
T | No description available
a | No description available
o | No description available
> hide cartoons
> show cartoons
> hide atoms
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/4w2e_aligned_d266_30s.pdb
Chain information for 4w2e_aligned_d266_30s.pdb #2
---
Chain | Description
0 | No description available
1 | No description available
2 | No description available
3 | No description available
4 | No description available
5 | No description available
6 | No description available
7 | No description available
8 | No description available
9 | No description available
A | No description available
B | No description available
D | No description available
E | No description available
F | No description available
G | No description available
H | No description available
J | No description available
K | No description available
N | No description available
O | No description available
P | No description available
Q | No description available
R | No description available
S | No description available
T | No description available
U | No description available
V | No description available
W | No description available
X | No description available
Y | No description available
Z | No description available
a | No description available
b | No description available
c | No description available
d | No description available
e | No description available
f | No description available
g | No description available
h | No description available
i | No description available
j | No description available
k | No description available
l | No description available
m | No description available
n | No description available
o | No description available
p | No description available
q | No description available
r | No description available
s | No description available
t | No description available
u | No description available
v | No description available
w | No description available
x | No description available
y | No description available
> show cartoons
> hide atoms
> select #2/A-Z
88492 atoms, 95142 bonds, 1256 pseudobonds, 7400 residues, 3 models selected
> hide sel cartoons
> select #2/1-8
4241 atoms, 4287 bonds, 15 pseudobonds, 539 residues, 2 models selected
> hide sel cartoons
Drag select of 293 residues
> select clear
Drag select of 85 residues
> select clear
Drag select of 116 residues
> hide sel cartoons
> lighting shadows false
> select clear
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/4w2e_aligned_d266_30s.pdb
Chain information for 4w2e_aligned_d266_30s.pdb #3
---
Chain | Description
0 | No description available
1 | No description available
2 | No description available
3 | No description available
4 | No description available
5 | No description available
6 | No description available
7 | No description available
8 | No description available
9 | No description available
A | No description available
B | No description available
D | No description available
E | No description available
F | No description available
G | No description available
H | No description available
J | No description available
K | No description available
N | No description available
O | No description available
P | No description available
Q | No description available
R | No description available
S | No description available
T | No description available
U | No description available
V | No description available
W | No description available
X | No description available
Y | No description available
Z | No description available
a | No description available
b | No description available
c | No description available
d | No description available
e | No description available
f | No description available
g | No description available
h | No description available
i | No description available
j | No description available
k | No description available
l | No description available
m | No description available
n | No description available
o | No description available
p | No description available
q | No description available
r | No description available
s | No description available
t | No description available
u | No description available
v | No description available
w | No description available
x | No description available
y | No description available
> hide atoms
> show cartoons
> select #3/A-Z
88492 atoms, 95142 bonds, 1256 pseudobonds, 7400 residues, 3 models selected
> hide sel cartoons
> close #3
> undo
Undo failed, probably because structures have been modified.
> select #2/A-Z
88492 atoms, 95142 bonds, 1256 pseudobonds, 7400 residues, 3 models selected
> hide sel cartoons
> select #2/1-8
4241 atoms, 4287 bonds, 15 pseudobonds, 539 residues, 2 models selected
> hide sel cartoons
> open
> /yonath_group/disha/Gingivalis/delta266/models/comparision/7k00_aligned_d266_30s.pdb
Chain information for 7k00_aligned_d266_30s.pdb #3
---
Chain | Description
0 | No description available
1 | No description available
2 | No description available
3 | No description available
4 | No description available
5 | No description available
A | No description available
B | No description available
C | No description available
D | No description available
E | No description available
F | No description available
G | No description available
H | No description available
I | No description available
J | No description available
K | No description available
L | No description available
M | No description available
N | No description available
O | No description available
P | No description available
Q | No description available
R | No description available
S | No description available
T | No description available
U | No description available
X | No description available
Y | No description available
Z | No description available
a | No description available
b | No description available
c | No description available
d | No description available
e | No description available
f | No description available
g | No description available
h | No description available
i | No description available
j | No description available
k | No description available
l | No description available
m | No description available
n | No description available
o | No description available
p | No description available
q | No description available
r | No description available
s | No description available
t | No description available
u | No description available
v | No description available
w | No description available
x | No description available
y | No description available
z | No description available
> hide sel atoms
> hide sel atoms
> hide sel atoms
> show sel cartoons
> select #3
149338 atoms, 154090 bonds, 1515 pseudobonds, 17719 residues, 3 models
selected
> hide sel atoms
> show sel cartoons
> select #3/A-Z
57623 atoms, 59725 bonds, 410 pseudobonds, 6581 residues, 3 models selected
> select #3/a-z
89518 atoms, 92211 bonds, 1092 pseudobonds, 10802 residues, 3 models selected
> hide sel cartoons
Drag select of 328 residues
> hide sel cartoons
Drag select of 363 residues
> hide sel cartoons
Drag select of 73 residues
> hide sel cartoons
> select all
346409 atoms, 365571 bonds, 3229 pseudobonds, 34413 residues, 8 models
selected
> hide sel cartoons
> select #1/B
Nothing selected
> select #1/C
1070 atoms, 1078 bonds, 12 pseudobonds, 142 residues, 2 models selected
> show sel cartoons
> select #2/B
2625 atoms, 2878 bonds, 37 pseudobonds, 172 residues, 2 models selected
> show sel cartoons
> select #2/b
1850 atoms, 1885 bonds, 231 residues, 1 model selected
> show sel cartoons
> select #2/C
Nothing selected
> select #2/c
1550 atoms, 1574 bonds, 206 residues, 1 model selected
> show sel cartoons
> select #3/c
2183 atoms, 2121 bonds, 2 pseudobonds, 372 residues, 2 models selected
> show sel cartoons
> select #3
149338 atoms, 154090 bonds, 1515 pseudobonds, 17719 residues, 3 models
selected
> show sel cartoons
> hide sel cartoons
> select #3/C
1670 atoms, 1651 bonds, 252 residues, 1 model selected
> show sel cartoons
> ui tool show Matchmaker
> matchmaker #!2 to #1 matrix Nucleic
Parameters
---
Chain pairing | bb
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 merged_FR_30S_D266_real_space_refined-coot-4.pdb, chain a (#1) with
4w2e_aligned_d266_30s.pdb, chain a (#2), sequence alignment score = 3375.9
RMSD between 584 pruned atom pairs is 1.307 angstroms; (across all 1352 pairs:
6.372)
> ui tool show Matchmaker
> matchmaker #!3 to #1 matrix Nucleic
Parameters
---
Chain pairing | bb
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 merged_FR_30S_D266_real_space_refined-coot-4.pdb, chain a (#1) with
7k00_aligned_d266_30s.pdb, chain A (#3), sequence alignment score = 3392.4
RMSD between 605 pruned atom pairs is 1.339 angstroms; (across all 1350 pairs:
12.255)
> hide #!3 models
> hide #!2 models
> show #!2 models
> open
> /yonath_group/disha/Gingivalis/delta266/swissmodels/RPS3/Untitled_Project/models/01/model.pdb
model.pdb title:
SWISS-MODEL SERVER (https://swissmodel.expasy.org) Untitled Project [more
info...]
Chain information for model.pdb #4
---
Chain | Description
8 | No description available
QXcbConnection: XCB error: 3 (BadWindow), sequence: 43785, resource id:
31503556, major code: 40 (TranslateCoords), minor code: 0
> ui tool show Matchmaker
> matchmaker #4 to #1 matrix Nucleic
No chains in match structure model.pdb #4 compatible with Nucleic similarity
matrix
> ui tool show Matchmaker
> matchmaker #4 to #1 matrix BLOSUM-30
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-30
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 merged_FR_30S_D266_real_space_refined-coot-4.pdb, chain C (#1) with
model.pdb, chain 8 (#4), sequence alignment score = 694
RMSD between 132 pruned atom pairs is 0.966 angstroms; (across all 142 pairs:
2.993)
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!2 models
> show #!2 models
> hide #!1 models
> ui tool show Matchmaker
> matchmaker #4 to #2 matrix BLOSUM-30
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-30
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 4w2e_aligned_d266_30s.pdb, chain c (#2) with model.pdb, chain 8
(#4), sequence alignment score = 670.2
RMSD between 186 pruned atom pairs is 0.990 angstroms; (across all 205 pairs:
1.282)
> show #!3 models
> show #!1 models
> save
> /yonath_group/disha/Gingivalis/delta266/models/comparision/SSU/rps3_chaiN_C.cxs
——— End of log from Tue May 17 14:49:39 2022 ———
opened ChimeraX session
> select all
348024 atoms, 367204 bonds, 3229 pseudobonds, 34619 residues, 9 models
selected
> hide sel cartoons
> select #3/D
1654 atoms, 1665 bonds, 216 residues, 1 model selected
> show sel cartoons
> select #1/D
1584 atoms, 1617 bonds, 200 residues, 1 model selected
> show sel cartoons
> select #2/d
1663 atoms, 1697 bonds, 3 pseudobonds, 209 residues, 2 models selected
> show sel cartoons
> ui tool show Matchmaker
> matchmaker #3/D to #1/D pairing ss
Parameters
---
Chain pairing | ss
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 merged_FR_30S_D266_real_space_refined-coot-4.pdb, chain D (#1) with
7k00_aligned_d266_30s.pdb, chain D (#3), sequence alignment score = 575.8
RMSD between 171 pruned atom pairs is 0.855 angstroms; (across all 199 pairs:
2.363)
> ui tool show Matchmaker
> matchmaker #2/d to #1/D pairing ss
Parameters
---
Chain pairing | ss
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 merged_FR_30S_D266_real_space_refined-coot-4.pdb, chain D (#1) with
4w2e_aligned_d266_30s.pdb, chain d (#2), sequence alignment score = 565.7
RMSD between 175 pruned atom pairs is 0.856 angstroms; (across all 200 pairs:
1.609)
> save
> /yonath_group/disha/Gingivalis/delta266/models/comparision/SSU/rps4_chaiN_D.cxs
> select clear
> select all
348024 atoms, 367204 bonds, 3229 pseudobonds, 34619 residues, 9 models
selected
> hide sel cartoons
> select #3/E
1167 atoms, 1165 bonds, 171 residues, 1 model selected
> show sel cartoons
> select #1/E
1109 atoms, 1122 bonds, 157 residues, 1 model selected
> show sel cartoons
> select #2/e
1130 atoms, 1145 bonds, 1 pseudobond, 149 residues, 2 models selected
> show sel cartoons
> ui tool show Matchmaker
> matchmaker #3/E to #1/E pairing ss
Parameters
---
Chain pairing | ss
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 merged_FR_30S_D266_real_space_refined-coot-4.pdb, chain E (#1) with
7k00_aligned_d266_30s.pdb, chain E (#3), sequence alignment score = 463
RMSD between 149 pruned atom pairs is 0.841 angstroms; (across all 155 pairs:
1.174)
> ui tool show Matchmaker
> matchmaker #2/e to #1/E pairing ss
Parameters
---
Chain pairing | ss
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 merged_FR_30S_D266_real_space_refined-coot-4.pdb, chain E (#1) with
4w2e_aligned_d266_30s.pdb, chain e (#2), sequence alignment score = 395.4
RMSD between 142 pruned atom pairs is 1.029 angstroms; (across all 148 pairs:
1.170)
> save
> /yonath_group/disha/Gingivalis/delta266/models/comparision/SSU/rps4_chaiN_E.cxs
> select all
348024 atoms, 367204 bonds, 3229 pseudobonds, 34619 residues, 9 models
selected
> hide sel cartoons
> select #1/F
878 atoms, 894 bonds, 107 residues, 1 model selected
> show sel cartoons
> show sel cartoons
> show sel cartoons
> view sel
> select #3/F
839 atoms, 858 bonds, 103 residues, 1 model selected
> show sel cartoons
> select #2/f
807 atoms, 819 bonds, 1 pseudobond, 101 residues, 2 models selected
> show sel cartoons
> ui tool show Matchmaker
> matchmaker #3/F to #1/F pairing ss
Parameters
---
Chain pairing | ss
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 merged_FR_30S_D266_real_space_refined-coot-4.pdb, chain F (#1) with
7k00_aligned_d266_30s.pdb, chain F (#3), sequence alignment score = 184.3
RMSD between 64 pruned atom pairs is 0.839 angstroms; (across all 93 pairs:
3.521)
Traceback (most recent call last):
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke
return self._func(self._name, data)
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
Error processing trigger "changes":
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
See log for complete Python traceback.
> ui tool show Matchmaker
> matchmaker #2/f to #1/F pairing ss
Parameters
---
Chain pairing | ss
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 merged_FR_30S_D266_real_space_refined-coot-4.pdb, chain F (#1) with
4w2e_aligned_d266_30s.pdb, chain f (#2), sequence alignment score = 91.1
RMSD between 79 pruned atom pairs is 1.065 angstroms; (across all 99 pairs:
3.309)
Traceback (most recent call last):
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke
return self._func(self._name, data)
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
Error processing trigger "changes":
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
See log for complete Python traceback.
> select clear
Traceback (most recent call last):
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke
return self._func(self._name, data)
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
Error processing trigger "changes":
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
See log for complete Python traceback.
> save
> /yonath_group/disha/Gingivalis/delta266/models/comparision/SSU/rps6_chaiN_F.cxs
> select all
348024 atoms, 367204 bonds, 3229 pseudobonds, 34619 residues, 9 models
selected
Traceback (most recent call last):
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke
return self._func(self._name, data)
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
Error processing trigger "changes":
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
See log for complete Python traceback.
> hide sel cartoons
Traceback (most recent call last):
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/core/triggerset.py", line 130, in invoke
return self._func(self._name, data)
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
Error processing trigger "changes":
RuntimeError: wrapped C/C++ object of type ChainMenuButton has been deleted
File "/opt/UCSF/ChimeraX/lib/python3.8/site-
packages/chimerax/ui/widgets/item_chooser.py", line 305, in _items_change
if not hasattr(self, '_recursion'):
See log for complete Python traceback.
OpenGL version: 3.3.0 NVIDIA 418.113
OpenGL renderer: Quadro RTX 4000/PCIe/SSE2
OpenGL vendor: NVIDIA Corporation
Manufacturer: ASUS
Model: System Product Name
OS: CentOS Stream 8
Architecture: 64bit ELF
Virutal Machine: none
CPU: 24 AMD Ryzen 9 5900X 12-Core Processor
Cache Size: 512 KB
Memory:
total used free shared buff/cache available
Mem: 62Gi 30Gi 20Gi 1.6Gi 12Gi 30Gi
Swap: 31Gi 5.3Gi 26Gi
Graphics:
05:00.0 VGA compatible controller [0300]: NVIDIA Corporation TU104GL [Quadro RTX 4000] [10de:1eb1] (rev a1)
Subsystem: NVIDIA Corporation Device [10de:12a0]
Kernel driver in use: nvidia
Locale: ('en_US', 'UTF-8')
PyQt5 5.15.2, Qt 5.15.2
Installed Packages:
alabaster: 0.7.12
appdirs: 1.4.4
Babel: 2.9.0
backcall: 0.2.0
blockdiag: 2.0.1
certifi: 2020.12.5
cftime: 1.4.1
chardet: 3.0.4
ChimeraX-AddCharge: 1.0
ChimeraX-AddH: 2.1.6
ChimeraX-AlignmentAlgorithms: 2.0
ChimeraX-AlignmentHdrs: 3.2
ChimeraX-AlignmentMatrices: 2.0
ChimeraX-Alignments: 2.1
ChimeraX-AmberInfo: 1.0
ChimeraX-Arrays: 1.0
ChimeraX-Atomic: 1.13.3
ChimeraX-AtomicLibrary: 3.1.2
ChimeraX-AtomSearch: 2.0
ChimeraX-AtomSearchLibrary: 1.0
ChimeraX-AxesPlanes: 2.0
ChimeraX-BasicActions: 1.1
ChimeraX-BILD: 1.0
ChimeraX-BlastProtein: 1.1
ChimeraX-BondRot: 2.0
ChimeraX-BugReporter: 1.0
ChimeraX-BuildStructure: 2.5.2
ChimeraX-Bumps: 1.0
ChimeraX-BundleBuilder: 1.1
ChimeraX-ButtonPanel: 1.0
ChimeraX-CageBuilder: 1.0
ChimeraX-CellPack: 1.0
ChimeraX-Centroids: 1.1
ChimeraX-ChemGroup: 2.0
ChimeraX-Clashes: 2.1
ChimeraX-ColorActions: 1.0
ChimeraX-ColorGlobe: 1.0
ChimeraX-ColorKey: 1.2.1
ChimeraX-CommandLine: 1.1.3
ChimeraX-ConnectStructure: 2.0
ChimeraX-Contacts: 1.0
ChimeraX-Core: 1.2
ChimeraX-CoreFormats: 1.0
ChimeraX-coulombic: 1.1.1
ChimeraX-Crosslinks: 1.0
ChimeraX-Crystal: 1.0
ChimeraX-CrystalContacts: 1.0
ChimeraX-DataFormats: 1.1
ChimeraX-Dicom: 1.0
ChimeraX-DistMonitor: 1.1.1
ChimeraX-DistUI: 1.0
ChimeraX-Dssp: 2.0
ChimeraX-EMDB-SFF: 1.0
ChimeraX-ExperimentalCommands: 1.0
ChimeraX-FileHistory: 1.0
ChimeraX-FunctionKey: 1.0
ChimeraX-Geometry: 1.1
ChimeraX-gltf: 1.0
ChimeraX-Graphics: 1.0
ChimeraX-Hbonds: 2.1
ChimeraX-Help: 1.1
ChimeraX-HKCage: 1.3
ChimeraX-IHM: 1.0
ChimeraX-ImageFormats: 1.1
ChimeraX-IMOD: 1.0
ChimeraX-IO: 1.0.1
ChimeraX-Label: 1.0
ChimeraX-LinuxSupport: 1.0
ChimeraX-ListInfo: 1.1.1
ChimeraX-Log: 1.1.2
ChimeraX-LookingGlass: 1.1
ChimeraX-Maestro: 1.8.1
ChimeraX-Map: 1.0.2
ChimeraX-MapData: 2.0
ChimeraX-MapEraser: 1.0
ChimeraX-MapFilter: 2.0
ChimeraX-MapFit: 2.0
ChimeraX-MapSeries: 2.0
ChimeraX-Markers: 1.0
ChimeraX-Mask: 1.0
ChimeraX-MatchMaker: 1.2
ChimeraX-MDcrds: 2.2
ChimeraX-MedicalToolbar: 1.0.1
ChimeraX-Meeting: 1.0
ChimeraX-MLP: 1.1
ChimeraX-mmCIF: 2.3
ChimeraX-MMTF: 2.1
ChimeraX-Modeller: 1.0.1
ChimeraX-ModelPanel: 1.0.1
ChimeraX-ModelSeries: 1.0
ChimeraX-Mol2: 2.0
ChimeraX-Morph: 1.0
ChimeraX-MouseModes: 1.1
ChimeraX-Movie: 1.0
ChimeraX-Neuron: 1.0
ChimeraX-Nucleotides: 2.0.1
ChimeraX-OpenCommand: 1.5
ChimeraX-PDB: 2.4.1
ChimeraX-PDBBio: 1.0
ChimeraX-PDBLibrary: 1.0
ChimeraX-PDBMatrices: 1.0
ChimeraX-PickBlobs: 1.0
ChimeraX-Positions: 1.0
ChimeraX-PresetMgr: 1.0.1
ChimeraX-PubChem: 2.0.1
ChimeraX-ReadPbonds: 1.0
ChimeraX-Registration: 1.1
ChimeraX-RemoteControl: 1.0
ChimeraX-ResidueFit: 1.0
ChimeraX-RestServer: 1.1
ChimeraX-RNALayout: 1.0
ChimeraX-RotamerLibMgr: 2.0
ChimeraX-RotamerLibsDunbrack: 2.0
ChimeraX-RotamerLibsDynameomics: 2.0
ChimeraX-RotamerLibsRichardson: 2.0
ChimeraX-SaveCommand: 1.4
ChimeraX-SchemeMgr: 1.0
ChimeraX-SDF: 2.0
ChimeraX-Segger: 1.0
ChimeraX-Segment: 1.0
ChimeraX-SeqView: 2.3
ChimeraX-Shape: 1.0.1
ChimeraX-Shell: 1.0
ChimeraX-Shortcuts: 1.0
ChimeraX-ShowAttr: 1.0
ChimeraX-ShowSequences: 1.0
ChimeraX-SideView: 1.0
ChimeraX-Smiles: 2.0.1
ChimeraX-SmoothLines: 1.0
ChimeraX-SpaceNavigator: 1.0
ChimeraX-StdCommands: 1.3.1
ChimeraX-STL: 1.0
ChimeraX-Storm: 1.0
ChimeraX-Struts: 1.0
ChimeraX-Surface: 1.0
ChimeraX-SwapAA: 2.0
ChimeraX-SwapRes: 2.1
ChimeraX-TapeMeasure: 1.0
ChimeraX-Test: 1.0
ChimeraX-Toolbar: 1.0.1
ChimeraX-ToolshedUtils: 1.2
ChimeraX-Tug: 1.0
ChimeraX-UI: 1.7.3
ChimeraX-uniprot: 2.1
ChimeraX-UnitCell: 1.0
ChimeraX-ViewDockX: 1.0
ChimeraX-Vive: 1.1
ChimeraX-VolumeMenu: 1.0
ChimeraX-VTK: 1.0
ChimeraX-WavefrontOBJ: 1.0
ChimeraX-WebCam: 1.0
ChimeraX-WebServices: 1.0
ChimeraX-Zone: 1.0
colorama: 0.4.3
comtypes: 1.1.7
cxservices: 1.0
cycler: 0.10.0
Cython: 0.29.21
decorator: 5.0.7
distlib: 0.3.1
distro: 1.5.0
docutils: 0.16
filelock: 3.0.12
funcparserlib: 0.3.6
grako: 3.16.5
h5py: 2.10.0
html2text: 2020.1.16
idna: 2.10
ihm: 0.17
imagecodecs: 2020.5.30
imagesize: 1.2.0
ipykernel: 5.3.4
ipython: 7.18.1
ipython-genutils: 0.2.0
jedi: 0.17.2
Jinja2: 2.11.2
jupyter-client: 6.1.7
jupyter-core: 4.7.1
kiwisolver: 1.3.1
line-profiler: 2.1.2
lxml: 4.6.2
lz4: 3.1.0
MarkupSafe: 1.1.1
matplotlib: 3.3.2
msgpack: 1.0.0
netCDF4: 1.5.4
networkx: 2.5
numexpr: 2.7.3
numpy: 1.19.2
numpydoc: 1.1.0
openvr: 1.14.1501
packaging: 20.9
ParmEd: 3.2.0
parso: 0.7.1
pexpect: 4.8.0
pickleshare: 0.7.5
Pillow: 7.2.0
pip: 21.0.1
pkginfo: 1.5.0.1
prompt-toolkit: 3.0.18
psutil: 5.7.2
ptyprocess: 0.7.0
pycollada: 0.7.1
pydicom: 2.0.0
Pygments: 2.7.1
PyOpenGL: 3.1.5
PyOpenGL-accelerate: 3.1.5
pyparsing: 2.4.7
PyQt5-commercial: 5.15.2
PyQt5-sip: 12.8.1
PyQtWebEngine-commercial: 5.15.2
python-dateutil: 2.8.1
pytz: 2021.1
pyzmq: 22.0.3
qtconsole: 4.7.7
QtPy: 1.9.0
RandomWords: 0.3.0
requests: 2.24.0
scipy: 1.5.2
setuptools: 50.3.2
sfftk-rw: 0.6.7.dev1
six: 1.15.0
snowballstemmer: 2.1.0
sortedcontainers: 2.2.2
Sphinx: 3.2.1
sphinxcontrib-applehelp: 1.0.2
sphinxcontrib-blockdiag: 2.0.0
sphinxcontrib-devhelp: 1.0.2
sphinxcontrib-htmlhelp: 1.0.3
sphinxcontrib-jsmath: 1.0.1
sphinxcontrib-qthelp: 1.0.3
sphinxcontrib-serializinghtml: 1.1.4
suds-jurko: 0.6
tables: 3.6.1
tifffile: 2020.9.3
tinyarray: 1.2.3
tornado: 6.1
traitlets: 5.0.5
urllib3: 1.25.11
wcwidth: 0.2.5
webcolors: 1.11.1
wheel: 0.36.0
wheel-filename: 1.2.0
Change History (2)
comment:1 by , 3 years ago
| Component: | Unassigned → Structure Comparison |
|---|---|
| Owner: | set to |
| Platform: | → all |
| Project: | → ChimeraX |
| Status: | new → accepted |
| Summary: | ChimeraX bug report submission → MatchMaker: wrapped C/C++ object of type ChainMenuButton has been deleted |
comment:2 by , 3 years ago
| Resolution: | → duplicate |
|---|---|
| Status: | accepted → closed |
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Hi Disha,
--Eric