| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
B |
90 |
23 |
6400 |
◊ |
A |
x,y,z |
1_555 |
93 |
26 |
6309 |
840.2 |
-10.5 |
0.186 |
18 |
0 |
0 |
0.660 |
| 2 |
2 |
|
B |
57 |
20 |
6400 |
x |
B |
x-1/2,-y+1/2,-z-1 |
4_454 |
43 |
16 |
6400 |
418.0 |
-2.6 |
0.549 |
4 |
0 |
0 |
0.000 |
| 3 |
3 |
|
A |
41 |
15 |
6309 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
47 |
18 |
6309 |
387.7 |
-3.0 |
0.486 |
5 |
1 |
0 |
0.000 |
| 4 |
4 |
|
B |
37 |
11 |
6400 |
◊ |
A |
-x-1,-y,z |
2_455 |
36 |
10 |
6309 |
306.1 |
-5.2 |
0.180 |
3 |
0 |
0 |
0.132 |
| 5 |
5 |
|
B |
35 |
15 |
6400 |
◊ |
B |
-x-1,-y,z |
2_455 |
35 |
15 |
6400 |
295.0 |
-5.1 |
0.081 |
2 |
0 |
0 |
0.247 |
6 |
|
A |
34 |
15 |
6309 |
◊ |
A |
-x-1,-y,z |
2_455 |
34 |
15 |
6309 |
281.5 |
-5.2 |
0.078 |
2 |
0 |
0 |
0.247 |
| Average: |
288.2 |
-5.1 |
0.080 |
2 |
0 |
0 |
0.247 |
| 6 |
7 |
|
[MKU]A:201 |
28 |
1 |
607 |
f |
A |
x,y,z |
1_555 |
32 |
13 |
6309 |
213.4 |
-4.9 |
0.346 |
0 |
0 |
0 |
0.398 |
8 |
|
[MKU]B:201 |
27 |
1 |
603 |
f |
B |
-x-1,-y,z |
2_455 |
30 |
13 |
6400 |
205.6 |
-4.6 |
0.353 |
0 |
0 |
0 |
0.398 |
| Average: |
209.5 |
-4.7 |
0.350 |
0 |
0 |
0 |
0.398 |
| 7 |
9 |
|
[MKU]A:201 |
27 |
1 |
607 |
◊ |
A |
-x-1,-y,z |
2_455 |
28 |
12 |
6309 |
180.7 |
-3.1 |
0.488 |
0 |
0 |
0 |
0.274 |
10 |
|
[MKU]B:201 |
27 |
1 |
603 |
◊ |
B |
x,y,z |
1_555 |
27 |
12 |
6400 |
180.4 |
-3.4 |
0.413 |
0 |
0 |
0 |
0.274 |
| Average: |
180.5 |
-3.2 |
0.451 |
0 |
0 |
0 |
0.274 |
| 8 |
11 |
|
B |
19 |
5 |
6400 |
◊ |
A |
x-1,y,z |
1_455 |
24 |
6 |
6309 |
169.6 |
1.2 |
0.802 |
2 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[MKU]A:201 |
22 |
1 |
607 |
◊ |
[MKU]A:201 |
-x-1,-y,z |
2_455 |
22 |
1 |
607 |
151.9 |
-2.6 |
0.984 |
0 |
0 |
0 |
0.110 |
13 |
|
[MKU]B:201 |
22 |
1 |
603 |
◊ |
[MKU]B:201 |
-x-1,-y,z |
2_455 |
22 |
1 |
603 |
150.0 |
-2.7 |
0.981 |
0 |
0 |
0 |
0.110 |
| Average: |
151.0 |
-2.6 |
0.983 |
0 |
0 |
0 |
0.110 |
| 10 |
14 |
|
A |
1 |
1 |
6309 |
x |
A |
x-1,y,z |
1_455 |
3 |
1 |
6309 |
13.6 |
0.0 |
0.655 |
0 |
0 |
0 |
0.000 |
| 11 |
15 |
|
[MKU]A:201 |
2 |
1 |
607 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
6400 |
4.4 |
-0.0 |
0.784 |
0 |
0 |
0 |
0.001 |
16 |
|
[MKU]B:201 |
2 |
1 |
603 |
◊ |
A |
-x-1,-y,z |
2_455 |
1 |
1 |
6309 |
4.2 |
-0.0 |
0.778 |
0 |
0 |
0 |
0.001 |
| Average: |
4.3 |
-0.0 |
0.781 |
0 |
0 |
0 |
0.001 |
| 12 |
17 |
|
[MKU]B:201 |
1 |
1 |
603 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
6309 |
0.9 |
-0.0 |
0.749 |
0 |
0 |
0 |
0.000 |
|