| ## |
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 |
71 |
19 |
13812 |
◊ |
B |
x-1,y,z-1 |
1_454 |
79 |
23 |
13517 |
617.6 |
4.2 |
0.685 |
8 |
4 |
0 |
0.000 |
2 |
|
A |
73 |
22 |
13812 |
◊ |
B |
x,y,z-1 |
1_554 |
55 |
17 |
13517 |
607.1 |
1.0 |
0.531 |
8 |
8 |
0 |
0.000 |
| Average: |
612.4 |
2.6 |
0.608 |
8 |
6 |
0 |
0.000 |
| 2 |
3 |
|
B |
61 |
19 |
13517 |
◊ |
A |
x,y,z |
1_555 |
63 |
20 |
13812 |
584.3 |
-0.6 |
0.448 |
11 |
6 |
0 |
0.000 |
| 3 |
4 |
|
A |
47 |
13 |
13812 |
x |
A |
-x+3,y-1/2,-z+3 |
2_848 |
37 |
10 |
13812 |
354.5 |
-2.4 |
0.300 |
6 |
0 |
0 |
0.000 |
| 4 |
5 |
|
A |
23 |
7 |
13812 |
x |
A |
x-1,y,z |
1_455 |
19 |
4 |
13812 |
175.0 |
0.2 |
0.495 |
0 |
1 |
0 |
0.000 |
6 |
|
B |
23 |
8 |
13517 |
x |
B |
x-1,y,z |
1_455 |
20 |
4 |
13517 |
170.8 |
1.8 |
0.706 |
3 |
5 |
0 |
0.000 |
| Average: |
172.9 |
1.0 |
0.600 |
2 |
3 |
0 |
0.000 |
| 5 |
7 |
|
[SO4]A:403 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
13812 |
81.0 |
-9.1 |
0.906 |
2 |
0 |
0 |
0.039 |
| 6 |
8 |
|
[SO4]B:403 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
13517 |
70.9 |
-8.3 |
0.869 |
2 |
0 |
0 |
0.037 |
| 7 |
9 |
|
[MN]B:402 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
13517 |
60.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.016 |
10 |
|
[MN]A:401 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
13812 |
60.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
60.7 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.016 |
| 8 |
11 |
|
A |
6 |
2 |
13812 |
◊ |
[SO4]B:403 |
x-1,y,z-1 |
1_454 |
4 |
1 |
184 |
53.9 |
-6.5 |
0.804 |
2 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[SO4]A:403 |
4 |
1 |
185 |
◊ |
B |
x,y,z-1 |
1_554 |
6 |
2 |
13517 |
51.5 |
-6.3 |
0.748 |
2 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[MN]B:401 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
13517 |
48.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.016 |
14 |
|
[MN]A:402 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
13812 |
46.2 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
47.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.016 |
| 11 |
15 |
|
[SO4]B:403 |
3 |
1 |
184 |
f |
[MN]B:402 |
x,y,z |
1_555 |
1 |
1 |
123 |
20.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.013 |
| 12 |
16 |
|
[SO4]A:403 |
3 |
1 |
185 |
f |
[MN]A:401 |
x,y,z |
1_555 |
1 |
1 |
123 |
19.6 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.012 |
| 13 |
17 |
|
[MN]A:402 |
1 |
1 |
123 |
f |
[MN]A:401 |
x,y,z |
1_555 |
1 |
1 |
123 |
17.5 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.007 |
| 14 |
18 |
|
[MN]B:402 |
1 |
1 |
123 |
f |
[MN]B:401 |
x,y,z |
1_555 |
1 |
1 |
123 |
17.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.007 |
| 15 |
19 |
|
[SO4]A:403 |
3 |
1 |
185 |
f |
[MN]A:402 |
x,y,z |
1_555 |
1 |
1 |
123 |
16.1 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.011 |
| 16 |
20 |
|
[MN]A:402 |
1 |
1 |
123 |
◊ |
B |
x,y,z-1 |
1_554 |
3 |
2 |
13517 |
15.7 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
21 |
|
A |
3 |
2 |
13812 |
◊ |
[MN]B:401 |
x-1,y,z-1 |
1_454 |
1 |
1 |
123 |
15.6 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
15.6 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[SO4]B:403 |
2 |
1 |
184 |
f |
[MN]B:401 |
x,y,z |
1_555 |
1 |
1 |
123 |
13.3 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.010 |
|