| ## |
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 |
|
B |
76 |
20 |
12432 |
x |
B |
z-1/2,-x-1/2,-y |
6_445 |
67 |
19 |
12432 |
650.0 |
-5.4 |
0.234 |
4 |
2 |
0 |
0.067 |
| 2 |
2 |
|
A |
61 |
15 |
12552 |
x |
A |
-z+1/2,-x,y+1/2 |
7_555 |
57 |
11 |
12552 |
502.7 |
-1.3 |
0.458 |
5 |
4 |
0 |
0.043 |
| 3 |
3 |
|
B |
44 |
12 |
12432 |
◊ |
A |
x,y,z |
1_555 |
46 |
12 |
12552 |
353.5 |
-1.2 |
0.508 |
4 |
8 |
0 |
0.000 |
| 4 |
4 |
|
A |
43 |
11 |
12552 |
◊ |
B |
z,x,y |
5_555 |
48 |
11 |
12432 |
352.7 |
-1.3 |
0.476 |
3 |
4 |
0 |
0.000 |
| 5 |
5 |
|
[V12]A:1277 |
29 |
1 |
616 |
f |
A |
x,y,z |
1_555 |
49 |
15 |
12552 |
316.2 |
-2.8 |
0.573 |
5 |
0 |
0 |
0.052 |
| 6 |
6 |
|
[V12]B:1277 |
27 |
1 |
589 |
f |
B |
x,y,z |
1_555 |
41 |
12 |
12432 |
288.5 |
-3.2 |
0.445 |
5 |
0 |
0 |
0.049 |
| 7 |
7 |
|
A |
33 |
10 |
12552 |
x |
A |
z,x,y |
5_555 |
32 |
11 |
12552 |
272.7 |
-0.4 |
0.495 |
3 |
2 |
0 |
0.000 |
| 8 |
8 |
|
[GOL]A:1271 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
25 |
11 |
12552 |
140.0 |
-1.1 |
0.435 |
3 |
0 |
0 |
0.026 |
| 9 |
9 |
|
[GOL]B:1273 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
25 |
11 |
12432 |
132.2 |
-1.1 |
0.410 |
3 |
0 |
0 |
0.022 |
| 10 |
10 |
|
[GOL]B:1272 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
21 |
13 |
12432 |
120.9 |
-0.2 |
0.543 |
6 |
0 |
0 |
0.026 |
| 11 |
11 |
|
[SO4]A:1269 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
20 |
14 |
12552 |
107.0 |
-15.1 |
0.769 |
5 |
0 |
0 |
0.180 |
| 12 |
12 |
|
[SO4]B:1269 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
12432 |
104.0 |
-14.8 |
0.732 |
3 |
0 |
0 |
0.146 |
| 13 |
13 |
|
[SO4]B:1270 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
16 |
9 |
12432 |
101.1 |
-15.0 |
0.683 |
4 |
0 |
0 |
0.151 |
| 14 |
14 |
|
[BR]B:1275 |
1 |
1 |
133 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
12432 |
76.7 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.126 |
15 |
|
[BR]A:1273 |
1 |
1 |
133 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
12552 |
76.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.126 |
| Average: |
76.5 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.126 |
| 15 |
16 |
|
[SO4]A:1270 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
12552 |
74.5 |
-9.2 |
0.953 |
4 |
0 |
0 |
0.114 |
| 16 |
17 |
|
[SO4]B:1271 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
12432 |
70.6 |
-9.0 |
0.937 |
6 |
0 |
0 |
0.105 |
| 17 |
18 |
|
[BR]B:1274 |
1 |
1 |
133 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
12432 |
68.2 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.107 |
19 |
|
[BR]A:1272 |
1 |
1 |
133 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
12552 |
67.1 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.107 |
| Average: |
67.7 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.107 |
| 18 |
20 |
|
[BR]A:1275 |
1 |
1 |
133 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
12552 |
63.9 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.084 |
| 19 |
21 |
|
[BR]A:1274 |
1 |
1 |
133 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
12552 |
58.5 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.088 |
| 20 |
22 |
|
[BR]A:1275 |
1 |
1 |
133 |
◊ |
A |
-z+1/2,-x,y+1/2 |
7_555 |
10 |
4 |
12552 |
50.4 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.058 |
| 21 |
23 |
|
[BR]B:1276 |
1 |
1 |
133 |
◊ |
B |
z-1/2,-x-1/2,-y |
6_445 |
8 |
4 |
12432 |
49.6 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.060 |
| 22 |
24 |
|
[BR]B:1276 |
1 |
1 |
133 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
12432 |
49.5 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.054 |
| 23 |
25 |
|
[BR]A:1276 |
1 |
1 |
133 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
12552 |
46.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.050 |
| 24 |
26 |
|
[BR]A:1274 |
1 |
1 |
133 |
◊ |
B |
z,x,y |
5_555 |
8 |
4 |
12432 |
40.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 25 |
27 |
|
A |
4 |
3 |
12552 |
◊ |
[BR]A:1276 |
-z+1/2,-x,y+1/2 |
7_555 |
1 |
1 |
133 |
33.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.035 |
| 26 |
28 |
|
[GOL]B:1272 |
4 |
1 |
218 |
f |
[SO4]B:1270 |
x,y,z |
1_555 |
4 |
1 |
186 |
33.2 |
-4.2 |
0.803 |
1 |
0 |
0 |
0.042 |
| 27 |
29 |
|
[V12]A:1277 |
3 |
1 |
616 |
f |
[SO4]A:1269 |
x,y,z |
1_555 |
4 |
1 |
185 |
31.0 |
-3.6 |
0.816 |
0 |
0 |
0 |
0.038 |
| 28 |
30 |
|
[V12]B:1277 |
4 |
1 |
589 |
f |
[GOL]B:1272 |
x,y,z |
1_555 |
2 |
1 |
218 |
29.2 |
-0.4 |
0.587 |
0 |
0 |
0 |
0.003 |
| 29 |
31 |
|
[GOL]B:1273 |
2 |
1 |
219 |
f |
[SO4]B:1269 |
x,y,z |
1_555 |
3 |
1 |
185 |
24.5 |
-2.5 |
0.863 |
2 |
0 |
0 |
0.031 |
| 30 |
32 |
|
[SO4]B:1270 |
2 |
1 |
186 |
f |
[SO4]B:1269 |
x,y,z |
1_555 |
2 |
1 |
185 |
13.7 |
-3.3 |
0.960 |
0 |
0 |
0 |
0.030 |
| 31 |
33 |
|
[BR]B:1276 |
1 |
1 |
133 |
◊ |
[GOL]B:1273 |
z-1/2,-x-1/2,-y |
6_445 |
3 |
1 |
219 |
9.5 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.008 |
| 32 |
34 |
|
[V12]A:1277 |
2 |
1 |
616 |
◊ |
B |
z,x,y |
5_555 |
1 |
1 |
12432 |
7.3 |
0.2 |
0.757 |
0 |
0 |
0 |
0.000 |
| 33 |
35 |
|
[BR]B:1276 |
1 |
1 |
133 |
◊ |
[SO4]B:1269 |
z-1/2,-x-1/2,-y |
6_445 |
1 |
1 |
185 |
0.3 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|