| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
100 |
31 |
11333 |
◊ |
A |
-x+1,y,-z |
2_655 |
100 |
31 |
11333 |
1035.9 |
-18.6 |
0.046 |
4 |
0 |
0 |
0.153 |
2 |
|
[HEC]A:1002 |
43 |
1 |
826 |
cf |
A |
x,y,z |
1_555 |
74 |
29 |
11333 |
588.6 |
-23.4 |
0.176 |
0 |
0 |
0 |
0.368 |
3 |
|
[HEC]A:1001 |
43 |
1 |
821 |
cf |
A |
x,y,z |
1_555 |
71 |
31 |
11333 |
569.9 |
-19.9 |
0.437 |
1 |
0 |
0 |
0.319 |
4 |
|
A |
64 |
21 |
11333 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
63 |
21 |
11333 |
553.6 |
-6.3 |
0.432 |
8 |
2 |
0 |
0.079 |
5 |
|
A |
33 |
12 |
11333 |
◊ |
A |
-x,y,-z |
2_555 |
33 |
12 |
11333 |
361.3 |
-7.2 |
0.101 |
0 |
0 |
0 |
0.000 |
6 |
|
A |
22 |
9 |
11333 |
x |
A |
-x+1/2,y-1/2,-z |
4_545 |
18 |
10 |
11333 |
180.9 |
-2.5 |
0.361 |
0 |
0 |
0 |
0.000 |
7 |
|
A |
14 |
5 |
11333 |
x |
A |
x,y,z-1 |
1_554 |
15 |
4 |
11333 |
130.1 |
-1.7 |
0.418 |
1 |
0 |
0 |
0.000 |
8 |
|
[PEG]A:1006 |
7 |
1 |
259 |
◊ |
A |
x,y,z |
1_555 |
17 |
8 |
11333 |
125.1 |
3.5 |
0.455 |
2 |
0 |
0 |
0.000 |
9 |
|
[SO3]A:1007 |
4 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
11333 |
90.1 |
0.1 |
0.692 |
6 |
0 |
0 |
0.040 |
10 |
|
[IOD]A:1003 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
17 |
5 |
11333 |
73.4 |
-0.4 |
0.734 |
0 |
0 |
0 |
0.007 |
11 |
|
[PEG]A:1005 |
4 |
1 |
257 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
11333 |
62.3 |
0.1 |
0.131 |
0 |
0 |
0 |
0.000 |
12 |
|
[SO4]A:1004 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
11333 |
61.0 |
-8.3 |
0.701 |
1 |
0 |
0 |
0.137 |
13 |
|
[PEG]A:1005 |
4 |
1 |
257 |
f |
[HEC]A:1002 |
x,y,z |
1_555 |
3 |
1 |
826 |
45.1 |
0.7 |
0.370 |
0 |
0 |
0 |
0.000 |
14 |
|
[PEG]A:1005 |
3 |
1 |
257 |
◊ |
[PEG]A:1005 |
-x,y,-z |
2_555 |
3 |
1 |
257 |
45.1 |
0.9 |
0.125 |
1 |
0 |
0 |
0.000 |
15 |
|
A |
9 |
5 |
11333 |
f |
[PEG]A:1006 |
-x+1/2,y-1/2,-z |
4_545 |
4 |
1 |
259 |
36.1 |
0.6 |
0.280 |
0 |
0 |
0 |
0.000 |
16 |
|
[IOD]A:1003 |
1 |
1 |
144 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
4 |
3 |
11333 |
31.5 |
-0.3 |
0.581 |
0 |
0 |
0 |
0.000 |
17 |
|
[PEG]A:1005 |
3 |
1 |
257 |
◊ |
A |
-x,y,-z |
2_555 |
5 |
3 |
11333 |
28.5 |
-1.1 |
0.088 |
0 |
0 |
0 |
0.000 |
18 |
|
[HEC]A:1002 |
4 |
1 |
826 |
f |
[HEC]A:1001 |
x,y,z |
1_555 |
3 |
1 |
821 |
27.3 |
-1.0 |
0.793 |
0 |
0 |
0 |
0.016 |
19 |
|
[SO3]A:1007 |
2 |
1 |
172 |
f |
[HEC]A:1001 |
x,y,z |
1_555 |
13 |
1 |
821 |
24.8 |
-1.4 |
0.661 |
0 |
0 |
0 |
0.022 |
20 |
|
[PEG]A:1005 |
3 |
1 |
257 |
◊ |
[HEC]A:1002 |
-x,y,-z |
2_555 |
2 |
1 |
826 |
12.5 |
-0.2 |
0.268 |
0 |
0 |
0 |
0.000 |
21 |
|
[SO4]A:1004 |
3 |
1 |
185 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
11333 |
9.3 |
-1.3 |
0.487 |
0 |
0 |
0 |
0.020 |
22 |
|
[SO4]A:1004 |
1 |
1 |
185 |
◊ |
[SO4]A:1004 |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
185 |
6.4 |
-1.5 |
0.800 |
0 |
0 |
0 |
0.012 |
23 |
|
[HEC]A:1001 |
3 |
1 |
821 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
11333 |
2.7 |
-0.1 |
0.796 |
0 |
0 |
0 |
0.001 |
|