| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
87 |
28 |
25442 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
74 |
26 |
25442 |
712.8 |
-6.3 |
0.250 |
4 |
0 |
0 |
0.000 |
2 |
|
[HEM]A:605 |
43 |
1 |
838 |
cf |
A |
x,y,z |
1_555 |
84 |
30 |
25442 |
571.1 |
-17.4 |
0.719 |
4 |
0 |
0 |
0.429 |
3 |
|
A |
57 |
19 |
25442 |
x |
A |
x-1,y,z |
1_455 |
54 |
17 |
25442 |
521.3 |
-6.3 |
0.054 |
6 |
2 |
0 |
0.000 |
4 |
|
A |
27 |
11 |
25442 |
x |
A |
-x-1,y-1/2,-z |
2_445 |
37 |
14 |
25442 |
286.8 |
-0.8 |
0.547 |
2 |
3 |
0 |
0.000 |
5 |
|
A |
28 |
9 |
25442 |
x |
A |
-x-1,y-1/2,-z+1 |
2_446 |
27 |
7 |
25442 |
222.2 |
-0.7 |
0.461 |
1 |
0 |
0 |
0.000 |
6 |
|
[NAG]A:610 |
12 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
20 |
9 |
25442 |
172.9 |
3.6 |
0.395 |
4 |
0 |
0 |
0.000 |
7 |
|
[NAG]A:604 |
14 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
14 |
5 |
25442 |
145.8 |
3.6 |
0.317 |
1 |
0 |
0 |
0.000 |
8 |
|
[NAG]A:612 |
13 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
20 |
6 |
25442 |
135.5 |
2.6 |
0.255 |
0 |
0 |
0 |
0.000 |
9 |
|
[SCN]A:608 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
25442 |
90.7 |
-2.8 |
0.444 |
0 |
0 |
0 |
0.063 |
10 |
|
[IOD]A:601 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
15 |
7 |
25442 |
89.4 |
0.4 |
0.817 |
0 |
0 |
0 |
0.000 |
11 |
|
[IOD]A:597 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
25442 |
87.4 |
-0.2 |
0.669 |
0 |
0 |
0 |
0.004 |
12 |
|
[SCN]A:607 |
3 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
4 |
25442 |
86.6 |
-2.3 |
0.654 |
1 |
0 |
0 |
0.062 |
13 |
|
[IOD]A:598 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
25442 |
84.3 |
1.1 |
0.932 |
0 |
0 |
0 |
0.000 |
14 |
|
[IOD]A:602 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
25442 |
83.2 |
0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
15 |
|
[IOD]A:600 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
25442 |
83.1 |
-0.3 |
0.673 |
0 |
0 |
0 |
0.006 |
16 |
|
[NAG]A:615 |
9 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
9 |
4 |
25442 |
82.9 |
2.1 |
0.369 |
0 |
0 |
0 |
0.000 |
17 |
|
[NAG]A:606 |
7 |
1 |
366 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
25442 |
79.0 |
1.9 |
0.423 |
0 |
0 |
0 |
0.000 |
18 |
|
[IOD]A:599 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
25442 |
78.8 |
0.1 |
0.761 |
0 |
0 |
0 |
0.000 |
19 |
|
[NAG]A:616 |
9 |
1 |
365 |
cf |
[NAG]A:615 |
x,y,z |
1_555 |
7 |
1 |
362 |
77.6 |
1.9 |
0.113 |
0 |
0 |
0 |
0.000 |
20 |
|
[NAG]A:613 |
8 |
1 |
359 |
cf |
[NAG]A:612 |
x,y,z |
1_555 |
7 |
1 |
364 |
76.9 |
1.9 |
0.122 |
1 |
0 |
0 |
0.000 |
21 |
|
[NAG]A:611 |
10 |
1 |
352 |
cf |
[NAG]A:610 |
x,y,z |
1_555 |
6 |
1 |
362 |
74.2 |
2.3 |
0.114 |
0 |
0 |
0 |
0.000 |
22 |
|
[NAG]A:606 |
10 |
1 |
366 |
cf |
[NAG]A:604 |
x,y,z |
1_555 |
7 |
1 |
360 |
68.4 |
1.8 |
0.097 |
0 |
0 |
0 |
0.000 |
23 |
|
[SCN]A:607 |
3 |
1 |
186 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
4 |
25442 |
64.3 |
-0.8 |
0.614 |
0 |
0 |
0 |
0.000 |
24 |
|
[BMA]A:617 |
6 |
1 |
289 |
cf |
[NAG]A:616 |
x,y,z |
1_555 |
8 |
1 |
365 |
64.0 |
1.1 |
0.098 |
0 |
0 |
0 |
0.000 |
25 |
|
[MAN]A:614 |
7 |
1 |
291 |
cf |
[NAG]A:613 |
x,y,z |
1_555 |
6 |
1 |
359 |
63.7 |
2.0 |
0.165 |
0 |
0 |
0 |
0.000 |
26 |
|
A |
9 |
4 |
25442 |
◊ |
[NAG]A:612 |
-x,y-1/2,-z+1 |
2_546 |
5 |
1 |
364 |
63.4 |
0.9 |
0.297 |
0 |
0 |
0 |
0.000 |
27 |
|
[IOD]A:603 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
25442 |
61.9 |
0.0 |
0.705 |
0 |
0 |
0 |
0.000 |
28 |
|
[BMA]A:617 |
6 |
1 |
289 |
cf |
[MAN]A:618 |
x,y,z |
1_555 |
5 |
1 |
294 |
61.6 |
0.9 |
0.156 |
0 |
0 |
0 |
0.000 |
29 |
|
[CYN]A:596 |
2 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
25442 |
54.6 |
0.5 |
0.800 |
0 |
0 |
0 |
0.000 |
30 |
|
[SCN]A:608 |
3 |
1 |
184 |
f |
[HEM]A:605 |
x,y,z |
1_555 |
14 |
1 |
838 |
47.3 |
-2.4 |
0.839 |
0 |
0 |
0 |
0.054 |
31 |
|
[NAG]A:613 |
6 |
1 |
359 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
25442 |
46.7 |
1.0 |
0.358 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
5 |
2 |
25442 |
f |
[IOD]A:603 |
x-1,y,z |
1_455 |
1 |
1 |
144 |
45.7 |
-0.5 |
0.412 |
0 |
0 |
0 |
0.012 |
33 |
|
[CYN]A:596 |
2 |
1 |
144 |
cf |
[HEM]A:605 |
x,y,z |
1_555 |
19 |
1 |
838 |
45.1 |
-1.7 |
0.500 |
0 |
0 |
0 |
0.038 |
34 |
|
[NAG]A:611 |
5 |
1 |
352 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
25442 |
44.5 |
1.4 |
0.424 |
0 |
0 |
0 |
0.000 |
35 |
|
[NAG]A:604 |
7 |
1 |
360 |
◊ |
[IOD]A:598 |
x,y,z |
1_555 |
1 |
1 |
144 |
35.9 |
0.5 |
0.296 |
0 |
0 |
0 |
0.000 |
36 |
|
A |
3 |
1 |
25442 |
◊ |
[NAG]A:604 |
x-1,y,z |
1_455 |
3 |
1 |
360 |
33.7 |
0.3 |
0.232 |
0 |
0 |
0 |
0.000 |
37 |
|
A |
6 |
2 |
25442 |
◊ |
[NAG]A:613 |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
359 |
25.4 |
0.0 |
0.356 |
0 |
0 |
0 |
0.000 |
38 |
|
[MAN]A:618 |
2 |
1 |
294 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
4 |
1 |
25442 |
25.0 |
0.3 |
0.373 |
0 |
0 |
0 |
0.000 |
39 |
|
[CYN]A:596 |
2 |
1 |
144 |
f |
[SCN]A:608 |
x,y,z |
1_555 |
1 |
1 |
184 |
22.3 |
-0.9 |
0.500 |
0 |
0 |
0 |
0.021 |
40 |
|
[NAG]A:616 |
2 |
1 |
365 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
25442 |
15.7 |
0.2 |
0.286 |
0 |
0 |
0 |
0.000 |
41 |
|
[NAG]A:616 |
2 |
1 |
365 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
25442 |
12.1 |
0.9 |
0.493 |
0 |
0 |
0 |
0.000 |
42 |
|
[BMA]A:617 |
1 |
1 |
289 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
25442 |
4.7 |
0.2 |
0.399 |
0 |
0 |
0 |
0.000 |
43 |
|
[MAN]A:614 |
1 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
25442 |
4.1 |
-0.0 |
0.243 |
0 |
0 |
0 |
0.000 |
44 |
|
A |
2 |
1 |
25442 |
f |
[IOD]A:598 |
x-1,y,z |
1_455 |
1 |
1 |
144 |
2.5 |
-0.0 |
0.703 |
0 |
0 |
0 |
0.000 |
45 |
|
[BMA]A:617 |
1 |
1 |
289 |
f |
[NAG]A:615 |
x,y,z |
1_555 |
1 |
1 |
362 |
1.7 |
0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
46 |
|
A |
1 |
1 |
25442 |
f |
[IOD]A:601 |
-x-1,y-1/2,-z |
2_445 |
1 |
1 |
144 |
0.8 |
-0.0 |
0.723 |
0 |
0 |
0 |
0.000 |
|