| ## |
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 |
118 |
29 |
12083 |
◊ |
A |
-x-1,-y+2,z |
4_475 |
117 |
28 |
12083 |
1248.2 |
-24.6 |
0.001 |
12 |
6 |
0 |
0.206 |
2 |
|
B |
125 |
31 |
11846 |
◊ |
B |
-x-1,-y+1,z |
4_465 |
125 |
31 |
11846 |
1242.8 |
-26.3 |
0.000 |
12 |
6 |
0 |
0.206 |
| Average: |
1245.5 |
-25.4 |
0.001 |
12 |
6 |
0 |
0.206 |
| 2 |
3 |
|
B |
61 |
17 |
11846 |
◊ |
A |
x-y+1,x+1,z+1/3 |
6_665 |
61 |
16 |
12083 |
574.8 |
-5.1 |
0.256 |
6 |
3 |
0 |
0.049 |
| 3 |
4 |
|
B |
36 |
11 |
11846 |
◊ |
A |
x,y,z |
1_555 |
38 |
11 |
12083 |
296.6 |
-2.7 |
0.358 |
5 |
0 |
0 |
0.000 |
| 4 |
5 |
|
[PT1]B:283 |
23 |
1 |
505 |
f |
B |
x,y,z |
1_555 |
41 |
18 |
11846 |
292.3 |
-0.9 |
0.589 |
7 |
0 |
0 |
0.051 |
6 |
|
[PT1]A:283 |
23 |
1 |
504 |
f |
A |
x,y,z |
1_555 |
40 |
18 |
12083 |
288.2 |
-1.0 |
0.583 |
7 |
0 |
0 |
0.051 |
| Average: |
290.3 |
-1.0 |
0.586 |
7 |
0 |
0 |
0.051 |
| 5 |
7 |
|
A |
31 |
15 |
12083 |
◊ |
A |
-y+1,-x+1,-z+2/3 |
10_665 |
31 |
15 |
12083 |
291.2 |
-4.5 |
0.152 |
0 |
0 |
0 |
0.000 |
| 6 |
8 |
|
B |
28 |
9 |
11846 |
◊ |
A |
x-y+1,-y+2,-z+1 |
8_676 |
19 |
4 |
12083 |
200.3 |
-1.6 |
0.359 |
0 |
0 |
0 |
0.000 |
| 7 |
9 |
|
A |
16 |
5 |
12083 |
◊ |
A |
y-1,x+1,-z+2/3 |
7_465 |
16 |
5 |
12083 |
117.9 |
1.2 |
0.773 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[SO4]A:278 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
12083 |
81.2 |
-11.6 |
0.788 |
3 |
0 |
0 |
0.159 |
| 9 |
11 |
|
[SO4]B:280 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
11846 |
78.5 |
-7.4 |
0.962 |
4 |
0 |
0 |
0.116 |
| 10 |
12 |
|
[SO4]A:280 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
12083 |
78.0 |
-7.7 |
0.956 |
3 |
0 |
0 |
0.111 |
| 11 |
13 |
|
[SO4]B:278 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
11846 |
77.6 |
-10.6 |
0.813 |
3 |
0 |
0 |
0.151 |
| 12 |
14 |
|
[SO4]A:282 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
12083 |
74.2 |
-9.9 |
0.862 |
4 |
0 |
0 |
0.143 |
| 13 |
15 |
|
[SO4]A:279 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
12083 |
72.5 |
-8.1 |
0.962 |
2 |
0 |
0 |
0.110 |
| 14 |
16 |
|
[SO4]B:282 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
11846 |
70.6 |
-9.5 |
0.893 |
2 |
0 |
0 |
0.131 |
| 15 |
17 |
|
[SO4]B:281 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
11846 |
67.9 |
-8.5 |
0.825 |
2 |
0 |
0 |
0.119 |
| 16 |
18 |
|
[SO4]A:281 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
12083 |
67.5 |
-8.6 |
0.825 |
2 |
0 |
0 |
0.117 |
| 17 |
19 |
|
[SO4]B:279 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
11846 |
66.8 |
-7.5 |
0.952 |
2 |
0 |
0 |
0.106 |
| 18 |
20 |
|
[PT1]A:283 |
6 |
1 |
504 |
f |
[SO4]A:278 |
x,y,z |
1_555 |
4 |
1 |
186 |
51.7 |
-6.8 |
0.659 |
0 |
0 |
0 |
0.083 |
| 19 |
21 |
|
[PT1]B:283 |
5 |
1 |
505 |
f |
[SO4]B:278 |
x,y,z |
1_555 |
4 |
1 |
185 |
48.7 |
-6.5 |
0.633 |
0 |
0 |
0 |
0.082 |
| 20 |
22 |
|
[PT1]A:283 |
5 |
1 |
504 |
◊ |
A |
-y+1,-x+1,-z+2/3 |
10_665 |
3 |
1 |
12083 |
31.2 |
0.3 |
0.684 |
0 |
0 |
0 |
0.000 |
| 21 |
23 |
|
[PT1]A:283 |
3 |
1 |
504 |
f |
[SO4]A:281 |
x,y,z |
1_555 |
3 |
1 |
185 |
18.6 |
-3.0 |
0.513 |
0 |
0 |
0 |
0.037 |
| 22 |
24 |
|
[PT1]B:283 |
2 |
1 |
505 |
f |
[SO4]B:281 |
x,y,z |
1_555 |
3 |
1 |
185 |
18.6 |
-3.0 |
0.444 |
0 |
0 |
0 |
0.038 |
| 23 |
25 |
|
[SO4]A:281 |
1 |
1 |
185 |
◊ |
A |
-y+1,-x+1,-z+2/3 |
10_665 |
2 |
1 |
12083 |
5.0 |
-0.6 |
0.751 |
0 |
0 |
0 |
0.000 |
| 24 |
26 |
|
B |
1 |
1 |
11846 |
◊ |
B |
x-y+1,-y+2,-z+1 |
8_676 |
1 |
1 |
11846 |
1.9 |
0.0 |
0.732 |
0 |
0 |
0 |
0.000 |
|