## |
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 |
84 |
24 |
8905 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
90 |
27 |
8477 |
809.3 |
-8.8 |
0.299 |
8 |
5 |
0 |
0.478 |
2 |
|
A |
53 |
14 |
8477 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
49 |
17 |
8477 |
471.7 |
-4.2 |
0.454 |
3 |
0 |
0 |
0.000 |
3 |
|
B |
43 |
11 |
8905 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
51 |
16 |
8477 |
429.7 |
-1.1 |
0.642 |
3 |
7 |
0 |
0.000 |
4 |
|
B |
34 |
10 |
8905 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
31 |
10 |
8477 |
345.2 |
-2.7 |
0.343 |
4 |
5 |
0 |
0.000 |
5 |
|
B |
36 |
11 |
8905 |
◊ |
A |
x,y,z |
1_555 |
29 |
7 |
8477 |
323.1 |
-0.4 |
0.673 |
4 |
7 |
0 |
0.000 |
6 |
|
B |
22 |
8 |
8905 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
15 |
5 |
8905 |
164.9 |
1.1 |
0.782 |
4 |
0 |
0 |
0.000 |
7 |
|
A |
17 |
6 |
8477 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
16 |
7 |
8905 |
125.7 |
-0.2 |
0.626 |
1 |
0 |
0 |
0.000 |
8 |
|
[EDO]B:205 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
8905 |
117.5 |
2.9 |
0.400 |
0 |
0 |
0 |
0.000 |
9 |
|
[EDO]B:207 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
8905 |
105.7 |
2.5 |
0.418 |
0 |
0 |
0 |
0.000 |
10 |
|
[EDO]B:206 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
8905 |
103.3 |
2.7 |
0.448 |
6 |
0 |
0 |
0.000 |
11 |
|
[EDO]B:203 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
8905 |
91.2 |
2.4 |
0.271 |
1 |
0 |
0 |
0.000 |
12 |
|
[EDO]B:208 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
8905 |
90.9 |
1.8 |
0.253 |
1 |
0 |
0 |
0.000 |
13 |
|
[EDO]B:204 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
16 |
6 |
8905 |
84.8 |
2.2 |
0.280 |
1 |
0 |
0 |
0.000 |
14 |
|
[EDO]B:209 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
11 |
6 |
8905 |
84.0 |
2.1 |
0.403 |
0 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:204 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
8477 |
83.4 |
2.6 |
0.290 |
1 |
0 |
0 |
0.000 |
16 |
|
[EDO]A:202 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
8477 |
80.6 |
1.4 |
0.718 |
5 |
0 |
0 |
0.029 |
17 |
|
[EDO]A:203 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
8477 |
72.5 |
2.8 |
0.532 |
2 |
0 |
0 |
0.000 |
18 |
|
B |
12 |
3 |
8905 |
◊ |
[EDO]A:205 |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
1 |
183 |
69.5 |
1.3 |
0.221 |
0 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:205 |
3 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
8477 |
66.6 |
2.1 |
0.306 |
1 |
0 |
0 |
0.000 |
20 |
|
A |
9 |
3 |
8477 |
x |
A |
x-1,y,z |
1_455 |
7 |
2 |
8477 |
63.0 |
-0.1 |
0.619 |
0 |
0 |
0 |
0.000 |
21 |
|
[CL]B:202 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
8905 |
62.5 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.347 |
22 |
|
B |
11 |
7 |
8905 |
f |
[EDO]A:203 |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
1 |
185 |
58.1 |
0.9 |
0.747 |
2 |
0 |
0 |
0.000 |
23 |
|
[CL]A:201 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
8477 |
54.2 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.258 |
24 |
|
[CL]B:201 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
8905 |
53.2 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.269 |
25 |
|
[CL]B:201 |
1 |
1 |
125 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
7 |
3 |
8477 |
53.2 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.224 |
26 |
|
A |
12 |
5 |
8477 |
◊ |
[CL]A:201 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
125 |
50.5 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
|
B |
7 |
1 |
8905 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
6 |
2 |
8477 |
49.3 |
-0.2 |
0.567 |
0 |
0 |
0 |
0.000 |
28 |
|
[EDO]B:204 |
3 |
1 |
186 |
f |
B |
x-1/2,-y-1/2,-z |
4_445 |
9 |
3 |
8905 |
48.8 |
1.7 |
0.855 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
5 |
2 |
8477 |
◊ |
[EDO]A:204 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
184 |
48.3 |
1.3 |
0.829 |
1 |
0 |
0 |
0.000 |
30 |
|
B |
7 |
3 |
8905 |
◊ |
[EDO]A:202 |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
1 |
186 |
48.2 |
1.4 |
0.564 |
1 |
0 |
0 |
0.000 |
31 |
|
[EDO]B:208 |
3 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
8477 |
45.0 |
1.2 |
0.752 |
0 |
0 |
0 |
0.000 |
32 |
|
[EDO]A:203 |
4 |
1 |
185 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
7 |
2 |
8477 |
27.4 |
0.6 |
0.796 |
0 |
0 |
0 |
0.000 |
33 |
|
[EDO]B:206 |
2 |
1 |
183 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
3 |
1 |
8477 |
24.2 |
0.6 |
0.876 |
1 |
0 |
0 |
0.000 |
34 |
|
B |
3 |
2 |
8905 |
x |
B |
-x-1/2,-y-1,z-1/2 |
2_444 |
6 |
2 |
8905 |
13.7 |
0.2 |
0.690 |
0 |
0 |
0 |
0.000 |
35 |
|
[EDO]A:205 |
1 |
1 |
183 |
f |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
8477 |
6.8 |
0.2 |
0.899 |
0 |
0 |
0 |
0.000 |
36 |
|
[EDO]B:209 |
1 |
1 |
185 |
f |
A |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
1 |
8477 |
6.8 |
0.1 |
0.838 |
0 |
0 |
0 |
0.000 |
37 |
|
[EDO]B:206 |
1 |
1 |
183 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
8477 |
5.9 |
0.1 |
0.576 |
0 |
0 |
0 |
0.000 |
38 |
|
B |
2 |
1 |
8905 |
f |
[EDO]A:204 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
184 |
5.3 |
-0.0 |
0.723 |
0 |
0 |
0 |
0.000 |
|