| ## |
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 |
198 |
52 |
19349 |
◊ |
A |
x,y,z |
1_555 |
197 |
56 |
19550 |
1984.4 |
-26.7 |
0.022 |
20 |
3 |
0 |
0.201 |
| 2 |
2 |
|
B |
106 |
24 |
19349 |
◊ |
B |
x-y,-y,-z+1/3 |
5_555 |
106 |
24 |
19349 |
993.3 |
-18.2 |
0.018 |
2 |
0 |
0 |
0.168 |
3 |
|
A |
102 |
23 |
19550 |
◊ |
A |
x-y,-y,-z+1/3 |
5_555 |
102 |
23 |
19550 |
966.0 |
-18.1 |
0.017 |
4 |
0 |
0 |
0.168 |
| Average: |
979.6 |
-18.1 |
0.017 |
3 |
0 |
0 |
0.168 |
| 3 |
4 |
|
B |
51 |
13 |
19349 |
◊ |
A |
x,y,z-1 |
1_554 |
51 |
15 |
19550 |
484.7 |
-3.1 |
0.394 |
4 |
2 |
0 |
0.000 |
| 4 |
5 |
|
A |
41 |
13 |
19550 |
◊ |
B |
-y,x-y-1,z+2/3 |
2_545 |
43 |
14 |
19349 |
407.1 |
-6.6 |
0.125 |
2 |
0 |
0 |
0.000 |
| 5 |
6 |
|
B |
21 |
7 |
19349 |
x |
B |
-y,x-y-1,z-1/3 |
2_544 |
21 |
9 |
19349 |
200.2 |
-2.9 |
0.241 |
1 |
0 |
0 |
0.000 |
| 6 |
7 |
|
A |
10 |
2 |
19550 |
x |
A |
-y,x-y-1,z-1/3 |
2_544 |
15 |
5 |
19550 |
143.1 |
-1.4 |
0.112 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
[GOL]B:507 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
27 |
12 |
19349 |
138.0 |
0.1 |
0.645 |
4 |
0 |
0 |
0.017 |
| 8 |
9 |
|
[GOL]A:504 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
27 |
10 |
19550 |
133.0 |
-0.3 |
0.557 |
3 |
0 |
0 |
0.028 |
| 9 |
10 |
|
[SO4]B:502 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
19349 |
122.8 |
-18.6 |
0.769 |
5 |
0 |
0 |
0.208 |
| 10 |
11 |
|
[SO4]A:501 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
19550 |
122.2 |
-18.2 |
0.777 |
4 |
0 |
0 |
0.340 |
| 11 |
12 |
|
[SO4]B:501 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
19349 |
119.1 |
-16.1 |
0.804 |
4 |
0 |
0 |
0.179 |
| 12 |
13 |
|
[SO4]B:504 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
19349 |
99.5 |
-13.9 |
0.908 |
5 |
0 |
0 |
0.161 |
| 13 |
14 |
|
[SO4]B:503 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
19349 |
84.9 |
-12.0 |
0.859 |
3 |
0 |
0 |
0.134 |
| 14 |
15 |
|
[CL]A:505 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
19550 |
67.9 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.156 |
16 |
|
[CL]B:506 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
19349 |
57.0 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.156 |
| Average: |
62.5 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.156 |
| 15 |
17 |
|
[MN]A:502 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
6 |
5 |
19550 |
62.6 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.096 |
18 |
|
[MN]B:505 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
4 |
4 |
19349 |
62.2 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.096 |
| Average: |
62.4 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.096 |
| 16 |
19 |
|
[SO4]B:503 |
5 |
1 |
186 |
◊ |
B |
-y,x-y-1,z-1/3 |
2_544 |
6 |
4 |
19349 |
58.5 |
-8.4 |
0.608 |
1 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[CL]A:503 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
19550 |
54.4 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.110 |
| 18 |
21 |
|
[CL]A:506 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
19550 |
43.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.090 |
22 |
|
[CL]B:508 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
19349 |
39.1 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.090 |
| Average: |
41.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.090 |
| 19 |
23 |
|
A |
2 |
1 |
19550 |
◊ |
B |
-y,x-y-1,z-1/3 |
2_544 |
3 |
1 |
19349 |
24.7 |
-0.7 |
0.208 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
[CL]A:505 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
19349 |
20.8 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.023 |
25 |
|
[CL]B:506 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
19550 |
14.6 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.023 |
| Average: |
17.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.023 |
| 21 |
26 |
|
A |
3 |
2 |
19550 |
◊ |
[CL]B:508 |
-y,x-y-1,z+2/3 |
2_545 |
1 |
1 |
125 |
18.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 22 |
27 |
|
[CL]A:506 |
1 |
1 |
125 |
◊ |
B |
-y,x-y-1,z+2/3 |
2_545 |
3 |
2 |
19349 |
14.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 23 |
28 |
|
[MN]B:505 |
1 |
1 |
123 |
f |
[SO4]B:502 |
x,y,z |
1_555 |
1 |
1 |
185 |
5.7 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.010 |
| 24 |
29 |
|
[SO4]B:503 |
1 |
1 |
186 |
f |
[SO4]B:501 |
x,y,z |
1_555 |
1 |
1 |
186 |
5.4 |
-1.3 |
0.800 |
0 |
0 |
0 |
0.013 |
| 25 |
30 |
|
[MN]A:502 |
1 |
1 |
123 |
f |
[SO4]A:501 |
x,y,z |
1_555 |
1 |
1 |
185 |
4.1 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.012 |
| 26 |
31 |
|
[GOL]B:507 |
1 |
1 |
220 |
◊ |
B |
x-y,-y,-z+1/3 |
5_555 |
1 |
1 |
19349 |
0.9 |
-0.0 |
0.591 |
0 |
0 |
0 |
0.000 |
|