## |
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 |
182 |
57 |
24100 |
x |
A |
x-1,y,z |
1_455 |
176 |
57 |
24100 |
1703.2 |
2.2 |
0.868 |
1 |
2 |
0 |
0.000 |
2 |
|
A |
19 |
6 |
24100 |
x |
A |
x-1/2,-y-1/2,-z-1 |
4_444 |
34 |
13 |
24100 |
237.0 |
-5.0 |
0.043 |
0 |
0 |
0 |
0.000 |
3 |
|
A |
25 |
6 |
24100 |
x |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
19 |
6 |
24100 |
203.4 |
-1.4 |
0.310 |
1 |
1 |
0 |
0.000 |
4 |
|
[EDO]A:501 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
19 |
10 |
24100 |
108.3 |
3.5 |
0.476 |
0 |
0 |
0 |
0.000 |
5 |
|
[PEG]A:506 |
7 |
1 |
263 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
24100 |
106.2 |
0.7 |
0.162 |
1 |
0 |
0 |
0.000 |
6 |
|
[EDO]A:502 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
24100 |
92.3 |
2.2 |
0.263 |
0 |
0 |
0 |
0.000 |
7 |
|
[EDO]A:505 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
24100 |
84.6 |
2.2 |
0.246 |
1 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:503 |
4 |
1 |
189 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
24100 |
84.5 |
2.3 |
0.276 |
1 |
0 |
0 |
0.000 |
9 |
|
A |
12 |
5 |
24100 |
◊ |
[EDO]A:504 |
x-1,y,z |
1_455 |
4 |
1 |
185 |
76.0 |
2.6 |
0.318 |
0 |
0 |
0 |
0.000 |
10 |
|
A |
11 |
3 |
24100 |
x |
A |
-x-1/2,-y,z-1/2 |
2_454 |
8 |
3 |
24100 |
74.0 |
-1.8 |
0.191 |
0 |
0 |
0 |
0.000 |
11 |
|
[PEG]A:507 |
6 |
1 |
265 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
24100 |
72.1 |
1.0 |
0.142 |
1 |
0 |
0 |
0.000 |
12 |
|
[AUC]A:508 |
3 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
15 |
4 |
24100 |
71.6 |
-1.9 |
0.260 |
0 |
0 |
0 |
0.000 |
13 |
|
[PEG]A:506 |
4 |
1 |
263 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
10 |
2 |
24100 |
56.8 |
1.3 |
0.321 |
0 |
0 |
0 |
0.000 |
14 |
|
[AUC]A:508 |
3 |
1 |
182 |
f |
[PEG]A:507 |
x,y,z |
1_555 |
5 |
1 |
265 |
48.2 |
0.0 |
0.238 |
0 |
0 |
0 |
0.000 |
15 |
|
[AUC]A:509 |
2 |
1 |
165 |
f |
[PEG]A:507 |
x,y,z |
1_555 |
6 |
1 |
265 |
47.4 |
1.0 |
0.317 |
0 |
0 |
0 |
0.000 |
16 |
|
A |
6 |
2 |
24100 |
x |
A |
-x,y-1/2,-z-1/2 |
3_544 |
3 |
3 |
24100 |
45.1 |
-0.3 |
0.495 |
0 |
0 |
0 |
0.000 |
17 |
|
[AUC]A:509 |
2 |
1 |
165 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
24100 |
42.7 |
-1.4 |
0.188 |
0 |
0 |
0 |
0.000 |
18 |
|
A |
4 |
1 |
24100 |
f |
[EDO]A:501 |
x-1,y,z |
1_455 |
4 |
1 |
186 |
38.2 |
0.5 |
0.691 |
0 |
0 |
0 |
0.000 |
19 |
|
A |
7 |
2 |
24100 |
◊ |
[AUC]A:509 |
x-1/2,-y-1/2,-z-1 |
4_444 |
2 |
1 |
165 |
30.4 |
-0.9 |
0.529 |
0 |
0 |
0 |
0.000 |
20 |
|
A |
6 |
1 |
24100 |
◊ |
[PEG]A:506 |
x-1/2,-y-1/2,-z-1 |
4_444 |
3 |
1 |
263 |
29.9 |
0.5 |
0.323 |
0 |
0 |
0 |
0.000 |
21 |
|
[AUC]A:509 |
1 |
1 |
165 |
f |
[AUC]A:508 |
x,y,z |
1_555 |
3 |
1 |
182 |
28.8 |
-1.6 |
0.593 |
0 |
0 |
0 |
0.000 |
22 |
|
A |
2 |
1 |
24100 |
f |
[EDO]A:502 |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
1 |
187 |
27.5 |
0.5 |
0.358 |
0 |
0 |
0 |
0.000 |
23 |
|
A |
4 |
1 |
24100 |
f |
[EDO]A:503 |
x-1/2,-y-1/2,-z-1 |
4_444 |
2 |
1 |
189 |
26.3 |
1.0 |
0.895 |
0 |
0 |
0 |
0.000 |
24 |
|
[PEG]A:506 |
3 |
1 |
263 |
◊ |
[PEG]A:507 |
x-1/2,-y-1/2,-z-1 |
4_444 |
2 |
1 |
265 |
25.6 |
1.2 |
0.260 |
0 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:504 |
2 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
24100 |
24.1 |
0.9 |
0.903 |
0 |
0 |
0 |
0.000 |
26 |
|
A |
6 |
2 |
24100 |
◊ |
[PEG]A:507 |
x-1/2,-y-1/2,-z-1 |
4_444 |
2 |
1 |
265 |
23.1 |
0.1 |
0.309 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:503 |
3 |
1 |
189 |
◊ |
A |
x-1/2,-y-1/2,-z-1 |
4_444 |
3 |
2 |
24100 |
23.1 |
0.2 |
0.475 |
0 |
0 |
0 |
0.000 |
28 |
|
A |
7 |
1 |
24100 |
◊ |
[AUC]A:508 |
x-1/2,-y-1/2,-z-1 |
4_444 |
2 |
1 |
182 |
22.0 |
0.1 |
0.474 |
0 |
0 |
0 |
0.000 |
29 |
|
[PEG]A:507 |
2 |
1 |
265 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
1 |
24100 |
11.7 |
0.2 |
0.269 |
0 |
0 |
0 |
0.000 |
30 |
|
[EDO]A:505 |
1 |
1 |
187 |
f |
A |
x-1,y,z |
1_455 |
2 |
2 |
24100 |
8.3 |
0.2 |
0.609 |
0 |
0 |
0 |
0.000 |
31 |
|
[EDO]A:503 |
1 |
1 |
189 |
◊ |
[AUC]A:509 |
x-1/2,-y-1/2,-z-1 |
4_444 |
1 |
1 |
165 |
7.5 |
0.3 |
0.707 |
0 |
0 |
0 |
0.000 |
32 |
|
[PEG]A:506 |
1 |
1 |
263 |
◊ |
[AUC]A:509 |
x-1/2,-y-1/2,-z-1 |
4_444 |
1 |
1 |
165 |
0.2 |
0.0 |
0.378 |
0 |
0 |
0 |
0.000 |
|