## |
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 |
|
B |
121 |
30 |
8049 |
◊ |
A |
x,y,z |
1_555 |
124 |
32 |
7630 |
1251.1 |
-18.4 |
0.179 |
22 |
7 |
2 |
0.339 |
2 |
|
A |
60 |
20 |
7630 |
◊ |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
55 |
16 |
8049 |
491.3 |
-3.8 |
0.627 |
5 |
2 |
0 |
0.008 |
3 |
|
B |
40 |
11 |
8049 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
44 |
14 |
7630 |
405.2 |
-4.8 |
0.401 |
3 |
5 |
0 |
0.075 |
4 |
|
B |
24 |
6 |
8049 |
x |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
25 |
8 |
8049 |
213.9 |
-3.4 |
0.316 |
0 |
0 |
0 |
0.000 |
5 |
|
[MPD]A:1159 |
7 |
1 |
276 |
f |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
25 |
8 |
8049 |
151.3 |
-9.9 |
0.808 |
0 |
0 |
0 |
0.108 |
6 |
|
[MPD]B:1161 |
7 |
1 |
275 |
f |
B |
x,y,z |
1_555 |
23 |
8 |
8049 |
149.5 |
-8.9 |
0.792 |
2 |
0 |
0 |
0.107 |
7 |
|
A |
10 |
4 |
7630 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
16 |
6 |
7630 |
123.7 |
-3.4 |
0.095 |
1 |
0 |
0 |
0.000 |
8 |
|
[SO4]B:1158 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
8049 |
114.6 |
-13.5 |
0.946 |
4 |
0 |
0 |
0.167 |
9 |
|
[MPD]B:1160 |
6 |
1 |
274 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
8049 |
98.5 |
-6.1 |
0.805 |
0 |
0 |
0 |
0.067 |
10 |
|
[BME]B:1159 |
4 |
1 |
204 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
8049 |
85.2 |
-2.9 |
0.242 |
2 |
0 |
0 |
0.041 |
11 |
|
[BME]A:1158 |
4 |
1 |
206 |
◊ |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
14 |
5 |
8049 |
79.3 |
1.5 |
0.698 |
1 |
0 |
0 |
0.000 |
12 |
|
[BME]B:1162 |
4 |
1 |
205 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
8049 |
79.1 |
-1.4 |
0.338 |
1 |
0 |
0 |
0.020 |
13 |
|
[BME]A:1161 |
4 |
1 |
206 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
7630 |
77.6 |
-2.3 |
0.339 |
1 |
0 |
0 |
0.030 |
14 |
|
[BME]A:1160 |
3 |
1 |
207 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
7630 |
75.7 |
-1.3 |
0.393 |
1 |
0 |
0 |
0.019 |
15 |
|
[MPD]A:1159 |
6 |
1 |
276 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
7630 |
72.2 |
-3.8 |
0.000 |
1 |
0 |
0 |
0.005 |
16 |
|
[BME]A:1158 |
4 |
1 |
206 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
7630 |
67.2 |
-3.0 |
0.276 |
2 |
0 |
0 |
0.042 |
17 |
|
B |
8 |
4 |
8049 |
◊ |
[SO4]A:1162 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
185 |
64.6 |
-7.7 |
0.957 |
5 |
0 |
0 |
0.108 |
18 |
|
[CL]B:1163 |
1 |
1 |
125 |
f |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
12 |
5 |
8049 |
63.4 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.126 |
19 |
|
[MPD]B:1161 |
4 |
1 |
275 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
7630 |
58.8 |
-2.7 |
0.930 |
0 |
0 |
0 |
0.025 |
20 |
|
[BME]A:1161 |
4 |
1 |
206 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
8049 |
50.3 |
-0.3 |
0.375 |
0 |
0 |
0 |
0.003 |
21 |
|
B |
7 |
3 |
8049 |
◊ |
[MPD]B:1160 |
-x-1,y-1/2,-z+1/2 |
3_445 |
4 |
1 |
274 |
47.3 |
-2.8 |
0.618 |
0 |
0 |
0 |
0.000 |
22 |
|
[BME]A:1161 |
2 |
1 |
206 |
f |
[BME]A:1160 |
x,y,z |
1_555 |
2 |
1 |
207 |
36.8 |
-0.5 |
0.438 |
0 |
0 |
0 |
0.005 |
23 |
|
[MPD]B:1161 |
4 |
1 |
275 |
◊ |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
3 |
3 |
8049 |
31.1 |
-2.0 |
0.416 |
0 |
0 |
0 |
0.000 |
24 |
|
[MPD]B:1160 |
5 |
1 |
274 |
f |
[BME]B:1162 |
x,y,z |
1_555 |
2 |
1 |
205 |
30.7 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.004 |
25 |
|
A |
3 |
3 |
7630 |
◊ |
B |
-x-3/2,-y,z-1/2 |
2_354 |
6 |
2 |
8049 |
30.7 |
0.7 |
0.851 |
0 |
0 |
0 |
0.000 |
26 |
|
[BME]A:1158 |
2 |
1 |
206 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
8049 |
30.1 |
-0.1 |
0.281 |
0 |
0 |
0 |
0.001 |
27 |
|
[SO4]B:1158 |
2 |
1 |
185 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
4 |
2 |
7630 |
24.2 |
-3.2 |
0.682 |
0 |
0 |
0 |
0.035 |
28 |
|
[BME]B:1162 |
2 |
1 |
205 |
◊ |
[BME]A:1161 |
x,y,z |
1_555 |
2 |
1 |
206 |
24.0 |
-0.6 |
0.438 |
1 |
0 |
0 |
0.009 |
29 |
|
[BME]B:1159 |
2 |
1 |
204 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
7630 |
21.6 |
-0.0 |
0.324 |
0 |
0 |
0 |
0.000 |
30 |
|
[BME]B:1159 |
2 |
1 |
204 |
◊ |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
2 |
1 |
8049 |
19.5 |
0.4 |
0.332 |
0 |
0 |
0 |
0.000 |
31 |
|
[SO4]B:1158 |
2 |
1 |
185 |
◊ |
[SO4]A:1162 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
185 |
14.9 |
-3.4 |
0.876 |
0 |
0 |
0 |
0.037 |
32 |
|
[CL]B:1163 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
8049 |
8.7 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
|
[SO4]A:1162 |
1 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
7630 |
5.6 |
-0.7 |
0.621 |
0 |
0 |
0 |
0.008 |
34 |
|
[CL]B:1163 |
1 |
1 |
125 |
◊ |
[BME]A:1158 |
x,y,z |
1_555 |
1 |
1 |
206 |
0.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|