Model quality ?

For models with atomic structures, MolProbity analysis is performed. For models with coarse-grained or multi-scale structures, excluded volume analysis is performed.

Standard geometry: bond outliers ?

There are 7 bond length outliers in this entry (0.09% of 7452 assessed bonds). A summary is provided below.

Chain Res Type Atoms |Z| Observed (Å) Ideal (Å) Model ID (Worst) Models (Total)
C
263
PRO
C-N
64.93
2.24
1.33
1
1
C
261
SER
C-N
35.78
0.83
1.33
1
1
D
413
LEU
CA-C
5.45
1.64
1.52
1
1
D
413
LEU
N-CA
5.29
1.56
1.46
1
1
D
412
SER
C-N
5.17
1.40
1.33
1
1
A
252
GLN
CA-C
4.06
1.61
1.52
1
1
D
413
LEU
C-N
4.02
1.41
1.34
1
1

Standard geometry: angle outliers ?

There are 68 bond angle outliers in this entry (0.73% of 9308 assessed bonds). A summary is provided below.

Chain Res Type Atoms |Z| Observed (Å) Ideal (Å) Model ID (Worst) Models (Total)
C
261
SER
O-C-N
53.53
37.35
123.00
1
1
C
263
PRO
O-C-N
20.46
155.74
123.00
1
1
C
263
PRO
CA-C-N
18.39
79.43
116.20
1
1
C
261
SER
CA-C-N
16.49
149.18
116.20
1
1
C
261
SER
C-N-CA
13.30
97.77
121.70
1
1
C
263
PRO
C-N-CA
10.68
102.48
121.70
1
1
D
253
HIS
C-N-CA
9.73
139.22
121.70
1
1
D
413
LEU
CA-C-N
9.66
131.39
116.90
1
1
D
410
ARG
C-N-CA
8.92
137.76
121.70
1
1
A
253
HIS
O-C-N
7.80
110.53
123.00
1
1
C
424
ARG
C-N-CA
7.77
135.68
121.70
1
1
D
86
PHE
C-N-CA
7.51
135.21
121.70
1
1
D
412
SER
C-N-CA
7.36
134.95
121.70
1
1
A
256
ILE
C-N-CA
7.19
134.64
121.70
1
1
C
454
VAL
C-N-CA
6.78
133.91
121.70
1
1
A
436
THR
C-N-CA
6.72
133.79
121.70
1
1
D
253
HIS
CA-C-N
6.65
129.51
116.20
1
1
B
435
ASP
C-N-CA
6.50
133.40
121.70
1
1
B
85
ASP
C-N-CA
6.50
133.40
121.70
1
1
C
435
ASP
C-N-CA
6.50
133.40
121.70
1
1
C
413
LEU
CA-C-N
6.37
126.46
116.90
1
1
D
447
VAL
C-N-CA
6.34
133.10
121.70
1
1
D
253
HIS
O-C-N
6.29
112.93
123.00
1
1
C
85
ASP
C-N-CA
6.02
132.54
121.70
1
1
A
436
THR
O-C-N
5.94
113.50
123.00
1
1
C
264
ASP
C-N-CA
5.79
132.13
121.70
1
1
D
412
SER
CA-C-O
5.66
111.17
120.80
1
1
D
254
VAL
C-N-CA
5.53
131.66
121.70
1
1
A
252
GLN
C-N-CA
5.49
131.58
121.70
1
1
D
412
SER
CA-C-N
5.48
127.15
116.20
1
1
C
417
ASN
C-N-CA
5.45
131.50
121.70
1
1
B
263
PRO
C-N-CA
5.42
131.46
121.70
1
1
D
414
PRO
N-CA-C
5.38
125.56
112.10
1
1
D
465
LEU
C-N-CA
5.35
131.34
121.70
1
1
A
250
GLN
C-N-CA
5.31
131.26
121.70
1
1
D
413
LEU
O-C-N
5.24
114.61
123.00
1
1
A
253
HIS
C-N-CA
5.07
130.83
121.70
1
1
D
447
VAL
CA-C-N
5.06
126.32
116.20
1
1
A
254
VAL
C-N-CA
4.94
130.58
121.70
1
1
C
454
VAL
O-C-N
4.88
115.20
123.00
1
1
C
436
THR
C-N-CA
4.77
130.29
121.70
1
1
A
257
ASP
N-CA-C
4.70
124.17
111.00
1
1
A
255
GLN
CA-C-N
4.65
106.89
116.20
1
1
A
426
THR
CA-C-O
4.64
112.91
120.80
1
1
D
414
PRO
C-N-CA
4.63
130.04
121.70
1
1
D
418
PHE
C-N-CA
4.54
129.86
121.70
1
1
A
436
THR
CA-C-N
4.51
125.23
116.20
1
1
C
423
LEU
C-N-CA
4.49
129.79
121.70
1
1
D
413
LEU
CA-C-O
4.47
113.20
120.80
1
1
C
415
LEU
CA-C-N
4.45
123.57
116.90
1
1
A
421
LEU
C-N-CA
4.40
129.62
121.70
1
1
B
264
ASP
C-N-CA
4.38
129.59
121.70
1
1
D
447
VAL
O-C-N
4.37
116.01
123.00
1
1
C
68
VAL
C-N-CA
4.34
129.52
121.70
1
1
A
264
ASP
C-N-CA
4.32
129.48
121.70
1
1
C
436
THR
O-C-N
4.26
116.18
123.00
1
1
C
435
ASP
O-C-N
4.25
116.20
123.00
1
1
A
260
VAL
C-N-CA
4.23
129.31
121.70
1
1
B
253
HIS
CA-C-N
4.20
124.59
116.20
1
1
B
435
ASP
CA-C-N
4.19
124.59
116.20
1
1
A
239
GLU
C-N-CA
4.18
129.22
121.70
1
1
C
24
PRO
C-N-CA
4.16
129.19
121.70
1
1
B
466
GLU
CA-C-O
4.09
113.85
120.80
1
1
D
96
PHE
C-N-CA
4.08
129.05
121.70
1
1
B
412
SER
O-C-N
4.07
116.48
123.00
1
1
A
2
SER
C-N-CA
4.07
129.02
121.70
1
1
A
10
SER
C-N-CA
4.04
128.97
121.70
1
1
A
18
PRO
C-N-CA
4.01
128.92
121.70
1
1

Too-close contacts ?

The following all-atom clashscore is based on a MolProbity analysis. All-atom clashscore is defined as the number of clashes found per 1000 atoms (including hydrogen atoms). The table below contains clashscores for all atomic models in this entry.

Model ID Clash score Number of clashes
1
1.49
14

There are 14 clashes. The table below contains the detailed list of all clashes based on a MolProbity analysis. Bad clashes are >= 0.4 Angstrom.

Atom 1 Atom 2 Clash(Å) Model ID (Worst) Models (Total)
C:261:SER:C
C:262:LYS:CA
1.52
1
1
C:263:PRO:C
C:264:ASP:N
0.96
1
1
C:261:SER:CA
C:262:LYS:N
0.95
1
1
C:261:SER:C
C:262:LYS:N
0.93
1
1
C:261:SER:O
C:262:LYS:CA
0.80
1
1
C:263:PRO:CA
C:264:ASP:N
0.77
1
1
C:261:SER:O
C:262:LYS:N
0.64
1
1
C:261:SER:CA
C:262:LYS:CA
0.53
1
1
D:409:SER:C
D:411:ILE:H
0.47
1
1
B:431:LEU:C
B:433:LEU:H
0.46
1
1
C:261:SER:C
C:262:LYS:C
0.46
1
1
D:95:GLU:C
D:97:LYS:H
0.43
1
1
C:17:GLY:C
C:19:GLY:HA3
0.41
1
1
C:263:PRO:C
C:264:ASP:CA
0.40
1
1

Torsion angles: Protein backbone ?

In the following table, Ramachandran outliers are listed. The Analysed column shows the number of residues for which the backbone conformation was analysed.

Model ID Analysed Favored Allowed Outliers
1
1854
1607
193
54

There are 54 unique backbone outliers. Detailed list of outliers are tabulated below.

Chain Res Type Models (Total)
A
9
SER
1
A
19
GLY
1
A
85
ASP
1
A
144
SER
1
A
257
ASP
1
A
258
VAL
1
A
263
PRO
1
A
265
LEU
1
A
413
LEU
1
A
414
PRO
1
A
437
HIS
1
B
4
ARG
1
B
21
ALA
1
B
34
SER
1
B
76
GLY
1
B
79
LEU
1
B
264
ASP
1
B
420
SER
1
B
431
LEU
1
B
435
ASP
1
B
437
HIS
1
B
438
SER
1
C
6
VAL
1
C
18
PRO
1
C
25
SER
1
C
62
ALA
1
C
69
ARG
1
C
71
ARG
1
C
85
ASP
1
C
200
GLU
1
C
265
LEU
1
C
413
LEU
1
C
414
PRO
1
C
418
PHE
1
C
420
SER
1
C
455
ILE
1
C
463
ASP
1
D
31
VAL
1
D
77
VAL
1
D
84
VAL
1
D
87
SER
1
D
142
GLY
1
D
252
GLN
1
D
254
VAL
1
D
255
GLN
1
D
259
ASP
1
D
411
ILE
1
D
412
SER
1
D
413
LEU
1
D
414
PRO
1
D
439
LYS
1
D
441
THR
1
D
446
THR
1
D
447
VAL
1

Torsion angles : Protein sidechains ?
In the following table, sidechain rotameric outliers are listed. The Analysed column shows the number of residues for which the sidechain conformation was analysed.

Model ID Analysed Favored Allowed Outliers
1
0
0
0
0