| ## |
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 |
|
D |
111 |
25 |
7250 |
◊ |
C |
x,y,z |
1_555 |
114 |
25 |
7315 |
1088.2 |
-16.5 |
0.041 |
12 |
0 |
0 |
0.319 |
2 |
|
B |
106 |
23 |
7413 |
◊ |
A |
x,y,z |
1_555 |
107 |
24 |
7230 |
1046.6 |
-17.1 |
0.024 |
9 |
0 |
0 |
0.319 |
| Average: |
1067.4 |
-16.8 |
0.033 |
11 |
0 |
0 |
0.319 |
| 2 |
3 |
|
[C2G]C:330 |
30 |
1 |
629 |
f |
C |
x,y,z |
1_555 |
66 |
27 |
7315 |
444.3 |
-5.3 |
0.611 |
15 |
0 |
0 |
0.342 |
4 |
|
[C2G]D:430 |
30 |
1 |
633 |
f |
D |
x,y,z |
1_555 |
64 |
27 |
7250 |
443.3 |
-3.9 |
0.717 |
17 |
0 |
0 |
0.342 |
5 |
|
[C2G]B:230 |
30 |
1 |
631 |
f |
B |
x,y,z |
1_555 |
62 |
28 |
7413 |
426.2 |
-4.0 |
0.666 |
17 |
0 |
0 |
0.342 |
6 |
|
[C2G]A:130 |
30 |
1 |
632 |
f |
A |
x,y,z |
1_555 |
64 |
26 |
7230 |
425.8 |
-3.8 |
0.717 |
15 |
0 |
0 |
0.342 |
| Average: |
434.9 |
-4.2 |
0.678 |
16 |
0 |
0 |
0.342 |
| 3 |
7 |
|
C |
48 |
9 |
7315 |
◊ |
A |
x,y,z |
1_555 |
46 |
11 |
7230 |
421.2 |
-4.4 |
0.226 |
3 |
1 |
0 |
0.000 |
8 |
|
D |
40 |
11 |
7250 |
◊ |
B |
x,y,z-1 |
1_554 |
39 |
9 |
7413 |
349.9 |
-2.9 |
0.371 |
4 |
1 |
0 |
0.000 |
| Average: |
385.5 |
-3.6 |
0.298 |
4 |
1 |
0 |
0.000 |
| 4 |
9 |
|
A |
40 |
9 |
7230 |
◊ |
B |
x,y,z-1 |
1_554 |
28 |
7 |
7413 |
297.4 |
-2.0 |
0.476 |
3 |
0 |
0 |
0.000 |
10 |
|
D |
31 |
8 |
7250 |
◊ |
C |
x,y,z-1 |
1_554 |
25 |
7 |
7315 |
226.3 |
-3.3 |
0.283 |
0 |
0 |
0 |
0.000 |
| Average: |
261.8 |
-2.6 |
0.380 |
2 |
0 |
0 |
0.000 |
| 5 |
11 |
|
B |
27 |
9 |
7413 |
◊ |
D |
x-1,y,z+1 |
1_456 |
30 |
11 |
7250 |
250.6 |
-1.6 |
0.472 |
1 |
1 |
0 |
0.000 |
| 6 |
12 |
|
B |
25 |
9 |
7413 |
◊ |
D |
x,y-1,z+1 |
1_546 |
25 |
9 |
7250 |
222.6 |
0.8 |
0.732 |
1 |
2 |
0 |
0.000 |
13 |
|
A |
23 |
8 |
7230 |
◊ |
C |
x,y-1,z |
1_545 |
21 |
7 |
7315 |
185.5 |
-0.5 |
0.595 |
2 |
1 |
0 |
0.000 |
| Average: |
204.1 |
0.1 |
0.664 |
2 |
2 |
0 |
0.000 |
| 7 |
14 |
|
B |
16 |
7 |
7413 |
◊ |
D |
x-1,y-1,z+1 |
1_446 |
17 |
7 |
7250 |
179.8 |
-1.0 |
0.476 |
2 |
4 |
0 |
0.000 |
| 8 |
15 |
|
A |
22 |
7 |
7230 |
◊ |
C |
x-1,y-1,z |
1_445 |
18 |
6 |
7315 |
157.6 |
1.3 |
0.766 |
4 |
2 |
0 |
0.000 |
| 9 |
16 |
|
A |
15 |
4 |
7230 |
◊ |
B |
x-1,y,z |
1_455 |
13 |
5 |
7413 |
107.0 |
-0.1 |
0.586 |
1 |
0 |
0 |
0.000 |
| 10 |
17 |
|
A |
9 |
4 |
7230 |
◊ |
D |
x-1,y-1,z+1 |
1_446 |
12 |
5 |
7250 |
101.7 |
-0.5 |
0.495 |
0 |
0 |
0 |
0.000 |
| 11 |
18 |
|
[SO4]D:702 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
15 |
9 |
7250 |
100.5 |
-14.7 |
0.788 |
7 |
0 |
0 |
0.261 |
| 12 |
19 |
|
[SO4]A:701 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
20 |
11 |
7230 |
95.6 |
-12.5 |
0.846 |
6 |
0 |
0 |
0.171 |
| 13 |
20 |
|
[SO4]B:705 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
7413 |
94.5 |
-13.6 |
0.752 |
6 |
0 |
0 |
0.184 |
| 14 |
21 |
|
[C2G]B:230 |
7 |
1 |
631 |
f |
[SO4]B:705 |
x,y,z |
1_555 |
5 |
1 |
185 |
59.4 |
-7.4 |
0.814 |
0 |
0 |
0 |
0.084 |
| 15 |
22 |
|
[C2G]A:130 |
8 |
1 |
632 |
f |
[SO4]A:701 |
x,y,z |
1_555 |
5 |
1 |
187 |
56.8 |
-6.6 |
0.842 |
0 |
0 |
0 |
0.075 |
| 16 |
23 |
|
[C2G]D:430 |
6 |
1 |
633 |
f |
[SO4]D:702 |
x,y,z |
1_555 |
5 |
1 |
186 |
48.7 |
-5.3 |
0.865 |
0 |
0 |
0 |
0.077 |
| 17 |
24 |
|
C |
4 |
2 |
7315 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
7413 |
41.2 |
-0.1 |
0.585 |
0 |
0 |
0 |
0.000 |
25 |
|
C |
5 |
2 |
7315 |
◊ |
B |
x,y,z-1 |
1_554 |
4 |
2 |
7413 |
31.1 |
-0.3 |
0.518 |
0 |
0 |
0 |
0.000 |
| Average: |
36.1 |
-0.2 |
0.552 |
0 |
0 |
0 |
0.000 |
| 18 |
26 |
|
D |
6 |
2 |
7250 |
x |
D |
x-1,y,z |
1_455 |
6 |
1 |
7250 |
37.7 |
-0.4 |
0.482 |
0 |
0 |
0 |
0.000 |
| 19 |
27 |
|
A |
6 |
3 |
7230 |
◊ |
C |
x-1,y,z |
1_455 |
7 |
3 |
7315 |
32.5 |
-0.4 |
0.527 |
0 |
0 |
0 |
0.000 |
| 20 |
28 |
|
A |
5 |
3 |
7230 |
x |
A |
x-1,y,z |
1_455 |
6 |
4 |
7230 |
28.7 |
0.6 |
0.758 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
[SO4]A:701 |
1 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
7315 |
14.8 |
-1.5 |
0.783 |
0 |
0 |
0 |
0.000 |
| 22 |
30 |
|
[SO4]D:702 |
1 |
1 |
186 |
◊ |
B |
x,y,z-1 |
1_554 |
2 |
1 |
7413 |
7.1 |
-0.7 |
0.764 |
0 |
0 |
0 |
0.000 |
| 23 |
31 |
|
B |
2 |
1 |
7413 |
◊ |
C |
x-1,y,z+1 |
1_456 |
1 |
1 |
7315 |
6.2 |
0.0 |
0.498 |
0 |
0 |
0 |
0.000 |
| 24 |
32 |
|
C |
1 |
1 |
7315 |
x |
C |
x-1,y,z |
1_455 |
1 |
1 |
7315 |
0.4 |
0.0 |
0.701 |
0 |
0 |
0 |
0.000 |
|