| ## |
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 |
194 |
51 |
17331 |
◊ |
A |
x,y,z |
1_555 |
194 |
51 |
17321 |
1788.9 |
-22.5 |
0.159 |
26 |
6 |
0 |
0.361 |
| 2 |
2 |
|
[NDP]B:502 |
47 |
1 |
889 |
f |
B |
x,y,z |
1_555 |
86 |
31 |
17331 |
649.0 |
-8.5 |
0.316 |
19 |
0 |
0 |
0.357 |
3 |
|
[NDP]A:501 |
47 |
1 |
892 |
f |
A |
x,y,z |
1_555 |
87 |
32 |
17321 |
648.1 |
-8.7 |
0.311 |
20 |
0 |
0 |
0.357 |
| Average: |
648.6 |
-8.6 |
0.313 |
20 |
0 |
0 |
0.357 |
| 3 |
4 |
|
B |
67 |
19 |
17331 |
◊ |
A |
x-y,x,z-1/6 |
2_554 |
66 |
19 |
17321 |
614.8 |
-9.0 |
0.198 |
4 |
0 |
0 |
0.000 |
| 4 |
5 |
|
A |
61 |
17 |
17321 |
◊ |
B |
x-1,y-1,z |
1_445 |
62 |
17 |
17331 |
514.1 |
-2.8 |
0.654 |
4 |
2 |
0 |
0.000 |
| 5 |
6 |
|
B |
26 |
8 |
17331 |
◊ |
A |
x-y+1,x+1,z-1/6 |
2_664 |
38 |
12 |
17321 |
286.3 |
-2.2 |
0.506 |
4 |
0 |
0 |
0.000 |
7 |
|
B |
36 |
11 |
17331 |
◊ |
A |
x-y,x+1,z-1/6 |
2_564 |
24 |
8 |
17321 |
252.3 |
-2.7 |
0.449 |
2 |
0 |
0 |
0.000 |
| Average: |
269.3 |
-2.4 |
0.478 |
3 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[NHE]A:505 |
13 |
1 |
366 |
f |
A |
x,y,z |
1_555 |
38 |
13 |
17321 |
247.5 |
7.3 |
0.619 |
1 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[NHE]B:507 |
13 |
1 |
367 |
f |
B |
x,y,z |
1_555 |
39 |
12 |
17331 |
246.0 |
7.6 |
0.544 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[FOM]B:504 |
11 |
1 |
327 |
f |
B |
x,y,z |
1_555 |
37 |
19 |
17331 |
180.0 |
-2.6 |
0.473 |
9 |
0 |
0 |
0.135 |
11 |
|
[FOM]A:503 |
11 |
1 |
323 |
f |
A |
x,y,z |
1_555 |
38 |
19 |
17321 |
177.4 |
-2.5 |
0.491 |
9 |
0 |
0 |
0.135 |
| Average: |
178.7 |
-2.5 |
0.482 |
9 |
0 |
0 |
0.135 |
| 9 |
12 |
|
[GOL]B:505 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
26 |
11 |
17331 |
117.7 |
-0.1 |
0.600 |
6 |
0 |
0 |
0.029 |
| 10 |
13 |
|
[GOL]A:504 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
26 |
11 |
17321 |
117.3 |
0.0 |
0.638 |
6 |
0 |
0 |
0.028 |
| 11 |
14 |
|
[GOL]B:506 |
6 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
17331 |
109.0 |
-0.3 |
0.553 |
1 |
0 |
0 |
0.008 |
| 12 |
15 |
|
[GOL]A:506 |
5 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
17321 |
78.9 |
1.3 |
0.804 |
3 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[GOL]B:501 |
5 |
1 |
218 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
17331 |
77.9 |
1.4 |
0.843 |
3 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[GOL]A:506 |
5 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
17331 |
65.5 |
-1.0 |
0.419 |
0 |
0 |
0 |
0.010 |
| 15 |
18 |
|
[GOL]B:501 |
5 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
17321 |
64.6 |
-1.0 |
0.431 |
0 |
0 |
0 |
0.011 |
| 16 |
19 |
|
B |
6 |
1 |
17331 |
◊ |
[GOL]B:501 |
x-y,x,z-1/6 |
2_554 |
5 |
1 |
218 |
48.5 |
0.1 |
0.614 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[GOL]A:506 |
4 |
1 |
220 |
◊ |
A |
x-y,x,z-1/6 |
2_554 |
6 |
1 |
17321 |
46.3 |
0.0 |
0.585 |
1 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[GOL]A:504 |
4 |
1 |
221 |
f |
[FOM]A:503 |
x,y,z |
1_555 |
7 |
1 |
323 |
38.0 |
-0.6 |
0.486 |
0 |
0 |
0 |
0.006 |
| 19 |
22 |
|
[FOM]B:504 |
5 |
1 |
327 |
f |
[NDP]B:502 |
x,y,z |
1_555 |
5 |
1 |
889 |
37.5 |
0.1 |
0.514 |
0 |
0 |
0 |
0.000 |
23 |
|
[FOM]A:503 |
5 |
1 |
323 |
f |
[NDP]A:501 |
x,y,z |
1_555 |
4 |
1 |
892 |
37.2 |
0.1 |
0.478 |
0 |
0 |
0 |
0.000 |
| Average: |
37.4 |
0.1 |
0.496 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
[GOL]B:505 |
4 |
1 |
221 |
f |
[FOM]B:504 |
x,y,z |
1_555 |
6 |
1 |
327 |
37.4 |
-0.3 |
0.548 |
0 |
0 |
0 |
0.003 |
| 21 |
25 |
|
[MG]B:503 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
17331 |
32.5 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.114 |
26 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
7 |
17321 |
31.6 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.114 |
| Average: |
32.0 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.114 |
| 22 |
27 |
|
B |
6 |
3 |
17331 |
x |
B |
x-y,x,z-1/6 |
2_554 |
2 |
1 |
17331 |
27.6 |
1.0 |
0.864 |
1 |
0 |
0 |
0.000 |
28 |
|
A |
2 |
1 |
17321 |
x |
A |
x-y,x,z-1/6 |
2_554 |
6 |
3 |
17321 |
27.5 |
1.1 |
0.866 |
1 |
0 |
0 |
0.000 |
| Average: |
27.5 |
1.1 |
0.865 |
1 |
0 |
0 |
0.000 |
| 23 |
29 |
|
[FOM]B:504 |
4 |
1 |
327 |
f |
[MG]B:503 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.1 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.057 |
30 |
|
[FOM]A:503 |
4 |
1 |
323 |
f |
[MG]A:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.0 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.057 |
| Average: |
26.0 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.057 |
| 24 |
31 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[NDP]A:501 |
x,y,z |
1_555 |
3 |
1 |
892 |
13.8 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.028 |
32 |
|
[MG]B:503 |
1 |
1 |
98 |
f |
[NDP]B:502 |
x,y,z |
1_555 |
2 |
1 |
889 |
13.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.028 |
| Average: |
13.7 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.028 |
| 25 |
33 |
|
[GOL]B:506 |
2 |
1 |
222 |
f |
[NDP]B:502 |
x,y,z |
1_555 |
3 |
1 |
889 |
6.3 |
-0.1 |
0.552 |
0 |
0 |
0 |
0.000 |
| 26 |
34 |
|
[GOL]A:504 |
2 |
1 |
221 |
f |
[MG]A:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
3.9 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.006 |
35 |
|
[GOL]B:505 |
1 |
1 |
221 |
f |
[MG]B:503 |
x,y,z |
1_555 |
1 |
1 |
98 |
2.5 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.006 |
| Average: |
3.2 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.006 |
|