## |
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 |
94 |
24 |
27725 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
83 |
25 |
27725 |
779.9 |
1.3 |
0.572 |
11 |
5 |
0 |
0.000 |
2 |
|
C |
72 |
8 |
2206 |
◊ |
A |
x,y,z |
1_555 |
88 |
31 |
27725 |
724.5 |
0.2 |
0.613 |
10 |
0 |
0 |
0.069 |
3 |
|
B |
74 |
9 |
2349 |
◊ |
A |
x,y,z |
1_555 |
86 |
32 |
27725 |
718.3 |
-14.2 |
0.200 |
17 |
0 |
0 |
0.494 |
4 |
|
A |
73 |
25 |
27725 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
69 |
22 |
27725 |
608.2 |
-4.2 |
0.251 |
7 |
2 |
0 |
0.000 |
5 |
|
C |
39 |
8 |
2206 |
◊ |
B |
x,y,z |
1_555 |
45 |
10 |
2349 |
397.1 |
-6.4 |
0.480 |
24 |
0 |
0 |
1.000 |
6 |
|
A |
23 |
8 |
27725 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
19 |
6 |
27725 |
171.7 |
0.5 |
0.613 |
2 |
0 |
0 |
0.000 |
7 |
|
[PBT]C:8 |
14 |
1 |
434 |
cf |
C |
x,y,z |
1_555 |
15 |
1 |
2206 |
133.6 |
1.4 |
0.639 |
0 |
0 |
0 |
0.000 |
8 |
|
[THM]C:9 |
12 |
1 |
389 |
cf |
C |
x,y,z |
1_555 |
17 |
2 |
2206 |
110.3 |
1.5 |
0.513 |
0 |
0 |
0 |
0.000 |
9 |
|
[SO4]A:1878 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
27725 |
82.4 |
-10.0 |
0.932 |
5 |
0 |
0 |
0.277 |
10 |
|
[THM]C:9 |
10 |
1 |
389 |
cf |
[PBT]C:8 |
x,y,z |
1_555 |
10 |
1 |
434 |
76.7 |
-0.2 |
0.289 |
0 |
0 |
0 |
0.012 |
11 |
|
[SO4]A:1877 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
27725 |
67.0 |
-8.3 |
0.871 |
4 |
0 |
0 |
0.228 |
12 |
|
[THM]C:9 |
8 |
1 |
389 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
27725 |
63.7 |
0.9 |
0.490 |
0 |
0 |
0 |
0.000 |
13 |
|
[THM]C:9 |
8 |
1 |
389 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
2349 |
62.7 |
1.3 |
0.468 |
2 |
0 |
0 |
0.000 |
14 |
|
[PBT]C:8 |
6 |
1 |
434 |
◊ |
A |
x,y,z |
1_555 |
11 |
6 |
27725 |
59.1 |
-1.5 |
0.351 |
0 |
0 |
0 |
0.024 |
15 |
|
[PBT]C:8 |
5 |
1 |
434 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
2349 |
58.3 |
0.7 |
0.585 |
0 |
0 |
0 |
0.000 |
16 |
|
A |
5 |
3 |
27725 |
◊ |
[SO4]A:1877 |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
1 |
185 |
55.9 |
-5.8 |
0.962 |
3 |
0 |
0 |
0.000 |
|