| ## |
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 |
|
[HEC]B:201 |
43 |
1 |
845 |
cf |
B |
x,y,z |
1_555 |
77 |
32 |
6182 |
586.6 |
-23.2 |
0.280 |
5 |
0 |
0 |
0.073 |
2 |
|
[HEC]A:201 |
43 |
1 |
839 |
cf |
A |
x,y,z |
1_555 |
76 |
32 |
6089 |
581.1 |
-23.5 |
0.296 |
5 |
0 |
0 |
0.073 |
| Average: |
583.8 |
-23.3 |
0.288 |
5 |
0 |
0 |
0.073 |
| 2 |
3 |
|
A |
43 |
13 |
6089 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
38 |
12 |
6182 |
359.4 |
-4.6 |
0.311 |
1 |
0 |
0 |
0.000 |
4 |
|
B |
32 |
11 |
6182 |
◊ |
A |
x,y,z |
1_555 |
31 |
11 |
6089 |
304.2 |
-5.1 |
0.170 |
1 |
0 |
0 |
0.000 |
| Average: |
331.8 |
-4.9 |
0.240 |
1 |
0 |
0 |
0.000 |
| 3 |
5 |
|
A |
17 |
6 |
6089 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
23 |
8 |
6182 |
184.0 |
2.8 |
0.886 |
0 |
2 |
0 |
0.000 |
| 4 |
6 |
|
B |
22 |
6 |
6182 |
x |
B |
-x+1,y-1/2,-z+2 |
2_647 |
15 |
5 |
6182 |
180.2 |
-0.6 |
0.598 |
0 |
1 |
0 |
0.000 |
| 5 |
7 |
|
[SO4]B:202 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
6182 |
80.1 |
-11.5 |
0.803 |
2 |
0 |
0 |
0.033 |
| 6 |
8 |
|
[SO4]A:202 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
6089 |
62.6 |
-8.5 |
0.724 |
2 |
0 |
0 |
0.027 |
| 7 |
9 |
|
A |
6 |
4 |
6089 |
x |
A |
-x,y-1/2,-z |
2_545 |
12 |
5 |
6089 |
59.3 |
0.7 |
0.717 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
A |
7 |
3 |
6089 |
◊ |
[HEC]B:201 |
-x,y-1/2,-z+1 |
2_546 |
4 |
1 |
845 |
57.5 |
-0.9 |
0.699 |
0 |
0 |
0 |
0.000 |
11 |
|
[HEC]A:201 |
4 |
1 |
839 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
6182 |
52.7 |
-0.7 |
0.724 |
0 |
0 |
0 |
0.000 |
| Average: |
55.1 |
-0.8 |
0.711 |
0 |
0 |
0 |
0.000 |
| 9 |
12 |
|
A |
4 |
2 |
6089 |
◊ |
[SO4]B:202 |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
184 |
48.6 |
-6.5 |
0.553 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[SO4]A:202 |
3 |
1 |
185 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
1 |
6182 |
31.4 |
-3.0 |
0.940 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
A |
3 |
1 |
6089 |
x |
A |
x,y-1,z |
1_545 |
1 |
1 |
6089 |
29.6 |
1.6 |
0.912 |
0 |
0 |
0 |
0.000 |
15 |
|
B |
3 |
1 |
6182 |
x |
B |
x,y-1,z |
1_545 |
2 |
1 |
6182 |
17.3 |
0.9 |
0.856 |
0 |
0 |
0 |
0.000 |
| Average: |
23.5 |
1.2 |
0.884 |
0 |
0 |
0 |
0.000 |
|