| ## |
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 |
75 |
28 |
17687 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
69 |
25 |
17664 |
635.3 |
2.3 |
0.751 |
8 |
0 |
0 |
0.000 |
2 |
|
B |
71 |
25 |
17687 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
72 |
27 |
17664 |
621.6 |
2.2 |
0.742 |
9 |
0 |
0 |
0.000 |
| Average: |
628.4 |
2.2 |
0.746 |
9 |
0 |
0 |
0.000 |
| 2 |
3 |
|
B |
60 |
15 |
17687 |
◊ |
A |
x,y,z |
1_555 |
59 |
15 |
17664 |
570.1 |
-4.8 |
0.299 |
4 |
4 |
0 |
0.103 |
| 3 |
4 |
|
A |
29 |
10 |
17664 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
27 |
9 |
17664 |
214.2 |
-0.2 |
0.624 |
1 |
0 |
0 |
0.000 |
| 4 |
5 |
|
[MES]B:1006 |
12 |
1 |
334 |
◊ |
B |
x,y,z |
1_555 |
29 |
11 |
17687 |
182.2 |
2.6 |
0.163 |
0 |
0 |
0 |
0.000 |
| 5 |
6 |
|
[MES]A:1005 |
12 |
1 |
331 |
◊ |
A |
x,y,z |
1_555 |
27 |
11 |
17664 |
179.2 |
2.6 |
0.177 |
0 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[SO4]A:1003 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
17664 |
83.8 |
-11.0 |
0.866 |
4 |
0 |
0 |
0.183 |
| 7 |
8 |
|
[SO4]B:1004 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
17687 |
83.7 |
-11.2 |
0.870 |
4 |
0 |
0 |
0.185 |
| 8 |
9 |
|
[MES]B:1006 |
4 |
1 |
334 |
f |
A |
-x-1/2,-y,z-1/2 |
2_454 |
6 |
4 |
17664 |
47.9 |
1.0 |
0.262 |
0 |
0 |
0 |
0.000 |
| 9 |
10 |
|
B |
5 |
4 |
17687 |
f |
[MES]A:1005 |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
1 |
331 |
45.5 |
0.9 |
0.242 |
0 |
0 |
0 |
0.000 |
| 10 |
11 |
|
B |
8 |
3 |
17687 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
17664 |
42.9 |
0.7 |
0.639 |
0 |
0 |
0 |
0.000 |
| 11 |
12 |
|
A |
4 |
2 |
17664 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
3 |
17687 |
40.7 |
1.3 |
0.895 |
2 |
2 |
0 |
0.000 |
| 12 |
13 |
|
B |
5 |
3 |
17687 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
3 |
2 |
17664 |
36.1 |
0.2 |
0.522 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[ZN]A:1001 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
17687 |
34.1 |
-19.4 |
0.000 |
0 |
0 |
0 |
0.557 |
15 |
|
[ZN]A:1001 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
17664 |
33.9 |
-19.5 |
0.000 |
0 |
0 |
0 |
0.557 |
| Average: |
34.0 |
-19.5 |
0.000 |
0 |
0 |
0 |
0.557 |
|