## |
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 |
45 |
13 |
13826 |
◊ |
A |
z-1/4,-y-1/4,x+1/4 |
22_445 |
44 |
13 |
13826 |
467.1 |
0.5 |
0.892 |
4 |
4 |
0 |
0.000 |
2 |
|
A |
42 |
14 |
13826 |
x |
A |
-y-1/4,x+1/4,z-1/4 |
16_454 |
40 |
14 |
13826 |
352.2 |
-1.0 |
0.711 |
4 |
0 |
0 |
0.000 |
3 |
|
[MK7]A:602 |
23 |
1 |
512 |
cf |
A |
x,y,z |
1_555 |
49 |
18 |
13826 |
323.1 |
-0.4 |
0.504 |
10 |
0 |
0 |
0.010 |
4 |
|
A |
40 |
13 |
13826 |
x |
A |
z,x,y |
5_555 |
31 |
10 |
13826 |
271.2 |
0.3 |
0.862 |
4 |
2 |
0 |
0.000 |
5 |
|
A |
23 |
10 |
13826 |
◊ |
A |
-z+1/4,-y+1/4,-x+1/4 |
24_555 |
22 |
9 |
13826 |
236.0 |
-4.7 |
0.143 |
0 |
0 |
0 |
0.000 |
6 |
|
[PEG]A:601 |
6 |
1 |
260 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
13826 |
123.2 |
3.4 |
0.432 |
0 |
0 |
0 |
0.000 |
7 |
|
[MES]A:605 |
9 |
1 |
334 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
13826 |
117.8 |
2.8 |
0.083 |
0 |
0 |
0 |
0.000 |
8 |
|
[SO4]A:606 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
13826 |
94.8 |
-14.3 |
0.783 |
3 |
0 |
0 |
0.031 |
9 |
|
[MES]A:605 |
9 |
1 |
334 |
◊ |
A |
z,x,y |
5_555 |
15 |
4 |
13826 |
93.6 |
2.5 |
0.097 |
0 |
0 |
0 |
0.000 |
10 |
|
[SO4]A:607 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
13826 |
50.8 |
-5.9 |
0.891 |
1 |
0 |
0 |
0.013 |
11 |
|
[SO4]A:607 |
4 |
1 |
186 |
f |
[MES]A:605 |
x,y,z |
1_555 |
8 |
1 |
334 |
48.2 |
-4.7 |
0.036 |
0 |
0 |
0 |
0.009 |
12 |
|
[SO4]A:606 |
4 |
1 |
185 |
f |
[MK7]A:602 |
x,y,z |
1_555 |
5 |
1 |
512 |
45.5 |
-4.2 |
0.752 |
0 |
0 |
0 |
0.008 |
13 |
|
[CL]A:608 |
1 |
1 |
125 |
x |
A |
x,y,z |
1_555 |
6 |
3 |
13826 |
42.5 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
14 |
|
[ZN]A:604 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
13826 |
41.4 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.041 |
15 |
|
[CL]A:608 |
1 |
1 |
125 |
f |
[ZN]A:603 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.7 |
-18.4 |
0.000 |
0 |
0 |
0 |
0.100 |
16 |
|
[ZN]A:603 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
7 |
4 |
13826 |
33.7 |
-18.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|