| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
A |
53 |
13 |
4741 |
x |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
58 |
13 |
4741 |
489.5 |
-6.8 |
0.116 |
2 |
1 |
0 |
0.000 |
| 2 |
2 |
|
A |
31 |
10 |
4741 |
x |
A |
x-1,y,z |
1_455 |
30 |
11 |
4741 |
219.5 |
-0.3 |
0.573 |
3 |
0 |
0 |
0.000 |
| 3 |
3 |
|
A |
26 |
6 |
4741 |
x |
A |
x-1/2,-y+3/2,-z |
4_465 |
33 |
10 |
4741 |
211.0 |
0.8 |
0.721 |
3 |
4 |
0 |
0.000 |
| 4 |
4 |
|
A |
10 |
5 |
4741 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
13 |
4 |
4741 |
68.6 |
0.3 |
0.619 |
0 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[CL]A:208 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
4741 |
48.1 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.004 |
| 6 |
6 |
|
A |
8 |
3 |
4741 |
f |
[ZN]A:203 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
98 |
43.4 |
-21.2 |
0.000 |
0 |
0 |
0 |
0.015 |
| 7 |
7 |
|
[ZN]A:207 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
4741 |
37.9 |
-20.6 |
0.000 |
0 |
0 |
0 |
0.026 |
8 |
|
[ZN]A:205 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
4741 |
31.1 |
-15.6 |
0.000 |
0 |
0 |
0 |
0.026 |
| Average: |
34.5 |
-18.1 |
0.000 |
0 |
0 |
0 |
0.026 |
| 8 |
9 |
|
[ZN]A:202 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
4741 |
37.3 |
-16.8 |
0.000 |
0 |
0 |
0 |
0.012 |
| 9 |
10 |
|
[ZN]A:206 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
4741 |
36.9 |
-19.4 |
0.000 |
0 |
0 |
0 |
0.014 |
| 10 |
11 |
|
[ZN]A:203 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
4741 |
35.0 |
-17.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[ZN]A:205 |
1 |
1 |
98 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
9 |
5 |
4741 |
34.7 |
-17.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[ZN]A:204 |
1 |
1 |
98 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
8 |
4 |
4741 |
32.8 |
-17.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[ZN]A:201 |
1 |
1 |
98 |
◊ |
A |
x-1/2,-y+3/2,-z |
4_465 |
12 |
5 |
4741 |
32.0 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 14 |
15 |
|
[ZN]A:204 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
4 |
2 |
4741 |
28.8 |
-13.1 |
0.000 |
0 |
0 |
0 |
0.010 |
| 15 |
16 |
|
A |
4 |
2 |
4741 |
◊ |
[CL]A:208 |
x-1/2,-y+3/2,-z |
4_465 |
1 |
1 |
125 |
28.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[ZN]A:201 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
4741 |
27.6 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.009 |
| 17 |
18 |
|
[ZN]A:207 |
1 |
1 |
98 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
10 |
5 |
4741 |
25.7 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 18 |
19 |
|
A |
7 |
2 |
4741 |
◊ |
[ZN]A:206 |
-x+2,y-1/2,-z+1/2 |
3_745 |
1 |
1 |
98 |
24.8 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 19 |
20 |
|
A |
3 |
1 |
4741 |
◊ |
[ZN]A:201 |
x-1/2,-y+3/2,-z |
4_465 |
1 |
1 |
98 |
21.9 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| 20 |
21 |
|
[ZN]A:202 |
1 |
1 |
98 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
2 |
4741 |
19.7 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 21 |
22 |
|
[ZN]A:204 |
1 |
1 |
98 |
◊ |
[ZN]A:206 |
-x+2,y-1/2,-z+1/2 |
3_745 |
1 |
1 |
98 |
19.0 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 22 |
23 |
|
[ZN]A:201 |
1 |
1 |
98 |
◊ |
[CL]A:208 |
x-1/2,-y+3/2,-z |
4_465 |
1 |
1 |
125 |
18.8 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 23 |
24 |
|
A |
3 |
1 |
4741 |
◊ |
[CL]A:208 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
18.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 24 |
25 |
|
[ZN]A:202 |
1 |
1 |
98 |
◊ |
A |
x-1/2,-y+3/2,-z |
4_465 |
4 |
2 |
4741 |
16.9 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 25 |
26 |
|
[ZN]A:207 |
1 |
1 |
98 |
f |
[ZN]A:205 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.3 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.008 |
| 26 |
27 |
|
[ZN]A:202 |
1 |
1 |
98 |
◊ |
A |
-x+3/2,-y+2,z-1/2 |
2_674 |
2 |
1 |
4741 |
13.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 27 |
28 |
|
A |
1 |
1 |
4741 |
x |
A |
-x+3/2,-y+2,z-1/2 |
2_674 |
2 |
2 |
4741 |
7.4 |
0.3 |
0.799 |
0 |
0 |
0 |
0.000 |
| 28 |
29 |
|
A |
2 |
1 |
4741 |
x |
A |
-x+5/2,-y+2,z-1/2 |
2_774 |
1 |
1 |
4741 |
3.5 |
0.0 |
0.671 |
0 |
0 |
0 |
0.000 |
| 29 |
30 |
|
[ZN]A:204 |
1 |
1 |
98 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
4741 |
2.8 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|