| ## |
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 |
72 |
14 |
14040 |
x |
A |
-x+3/2,-y,z-1/2 |
2_654 |
74 |
21 |
14040 |
647.6 |
-1.6 |
0.671 |
7 |
2 |
0 |
0.000 |
2 |
|
A |
29 |
9 |
14040 |
x |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
26 |
9 |
14040 |
311.3 |
-3.7 |
0.255 |
1 |
0 |
0 |
0.000 |
3 |
|
A |
31 |
10 |
14040 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
28 |
6 |
14040 |
273.5 |
-1.1 |
0.581 |
5 |
1 |
0 |
0.000 |
4 |
|
[CPS]A:402 |
21 |
1 |
798 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
26 |
10 |
14040 |
238.5 |
-0.3 |
0.293 |
0 |
0 |
0 |
0.000 |
5 |
|
[CPS]A:404 |
20 |
1 |
582 |
f |
A |
x,y,z |
1_555 |
25 |
11 |
14040 |
229.4 |
-0.3 |
0.202 |
0 |
0 |
0 |
0.000 |
6 |
|
[5XB]A:409 |
11 |
1 |
304 |
f |
A |
x,y,z |
1_555 |
33 |
13 |
14040 |
213.2 |
-7.5 |
0.530 |
5 |
0 |
0 |
0.018 |
7 |
|
[CPS]A:402 |
16 |
1 |
798 |
◊ |
A |
x,y,z |
1_555 |
27 |
8 |
14040 |
203.1 |
0.5 |
0.317 |
0 |
0 |
0 |
0.000 |
8 |
|
[CPS]A:403 |
14 |
1 |
839 |
f |
A |
x,y,z |
1_555 |
29 |
8 |
14040 |
199.1 |
-0.5 |
0.380 |
0 |
0 |
0 |
0.000 |
9 |
|
A |
22 |
9 |
14040 |
◊ |
[CPS]A:403 |
x-1/2,-y+1/2,-z |
4_455 |
15 |
1 |
839 |
192.6 |
-0.1 |
0.401 |
0 |
0 |
0 |
0.000 |
10 |
|
[SF4]A:401 |
8 |
1 |
307 |
f |
A |
x,y,z |
1_555 |
28 |
13 |
14040 |
191.8 |
-21.7 |
0.323 |
0 |
0 |
0 |
0.039 |
11 |
|
[CPS]A:406 |
15 |
1 |
512 |
f |
A |
x,y,z |
1_555 |
21 |
5 |
14040 |
163.7 |
-1.2 |
0.189 |
0 |
0 |
0 |
0.002 |
12 |
|
A |
16 |
7 |
14040 |
◊ |
[CPS]A:405 |
x-1/2,-y+1/2,-z |
4_455 |
9 |
1 |
531 |
132.7 |
2.1 |
0.420 |
0 |
0 |
0 |
0.000 |
13 |
|
A |
11 |
4 |
14040 |
◊ |
[CPS]A:406 |
x-1/2,-y+1/2,-z |
4_455 |
9 |
1 |
512 |
85.8 |
0.6 |
0.466 |
0 |
0 |
0 |
0.000 |
14 |
|
[CPS]A:406 |
7 |
1 |
512 |
◊ |
[CPS]A:402 |
x,y,z |
1_555 |
7 |
1 |
798 |
76.6 |
1.4 |
0.343 |
0 |
0 |
0 |
0.000 |
15 |
|
[CPS]A:405 |
8 |
1 |
531 |
◊ |
[CPS]A:404 |
x,y,z |
1_555 |
8 |
1 |
582 |
76.4 |
0.1 |
0.190 |
0 |
0 |
0 |
0.000 |
16 |
|
[CPS]A:402 |
6 |
1 |
798 |
◊ |
[CPS]A:404 |
x-1/2,-y+1/2,-z |
4_455 |
7 |
1 |
582 |
71.7 |
2.4 |
0.584 |
0 |
0 |
0 |
0.000 |
17 |
|
[CPS]A:405 |
6 |
1 |
531 |
◊ |
[CPS]A:403 |
x,y,z |
1_555 |
6 |
1 |
839 |
71.7 |
2.4 |
0.590 |
0 |
0 |
0 |
0.000 |
18 |
|
[CL]A:407 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
14040 |
71.3 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.021 |
19 |
|
[H2S]A:410 |
1 |
1 |
133 |
cf |
A |
x,y,z |
1_555 |
7 |
4 |
14040 |
70.8 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.010 |
20 |
|
[CPS]A:402 |
7 |
1 |
798 |
f |
[CPS]A:405 |
x-1/2,-y+1/2,-z |
4_455 |
7 |
1 |
531 |
70.1 |
-0.2 |
0.217 |
0 |
0 |
0 |
0.100 |
21 |
|
[CPS]A:402 |
7 |
1 |
798 |
◊ |
[CPS]A:403 |
x-1/2,-y+1/2,-z |
4_455 |
8 |
1 |
839 |
68.5 |
2.6 |
0.635 |
0 |
0 |
0 |
0.000 |
22 |
|
[H2S]A:411 |
1 |
1 |
133 |
cf |
A |
x,y,z |
1_555 |
8 |
3 |
14040 |
62.8 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.009 |
23 |
|
[CPS]A:404 |
6 |
1 |
582 |
f |
[CPS]A:403 |
x,y,z |
1_555 |
6 |
1 |
839 |
60.7 |
0.2 |
0.294 |
0 |
0 |
0 |
0.000 |
24 |
|
[CPS]A:405 |
4 |
1 |
531 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
14040 |
48.6 |
0.4 |
0.494 |
0 |
0 |
0 |
0.000 |
25 |
|
[CPS]A:406 |
3 |
1 |
512 |
◊ |
[CPS]A:405 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
531 |
40.8 |
0.7 |
0.433 |
0 |
0 |
0 |
0.000 |
26 |
|
[CPS]A:403 |
5 |
1 |
839 |
◊ |
A |
-x+5/2,-y,z-1/2 |
2_754 |
6 |
2 |
14040 |
39.0 |
0.5 |
0.592 |
0 |
0 |
0 |
0.000 |
27 |
|
[CPS]A:406 |
3 |
1 |
512 |
◊ |
[CPS]A:404 |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
582 |
28.4 |
0.8 |
0.496 |
0 |
0 |
0 |
0.000 |
28 |
|
A |
3 |
1 |
14040 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
14040 |
23.8 |
-0.1 |
0.255 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
1 |
1 |
14040 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
3 |
1 |
14040 |
14.2 |
0.3 |
0.816 |
0 |
0 |
0 |
0.000 |
30 |
|
[CPS]A:406 |
2 |
1 |
512 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
14040 |
10.7 |
-0.3 |
0.362 |
0 |
0 |
0 |
0.000 |
31 |
|
[H2S]A:411 |
1 |
1 |
133 |
f |
[H2S]A:410 |
x,y,z |
1_555 |
1 |
1 |
133 |
2.9 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
1 |
1 |
14040 |
x |
A |
-x+5/2,-y,z-1/2 |
2_754 |
1 |
1 |
14040 |
2.2 |
-0.0 |
0.577 |
0 |
0 |
0 |
0.000 |
|