| ## |
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 |
52 |
15 |
7721 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
56 |
17 |
7721 |
456.7 |
-2.6 |
0.457 |
6 |
2 |
0 |
0.000 |
| 2 |
2 |
|
B |
27 |
8 |
7721 |
◊ |
A |
x,y,z |
1_555 |
30 |
10 |
7904 |
288.5 |
1.1 |
0.767 |
8 |
0 |
0 |
0.000 |
| 3 |
3 |
|
A |
22 |
8 |
7904 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
31 |
12 |
7721 |
263.4 |
2.9 |
0.901 |
7 |
4 |
0 |
0.000 |
| 4 |
4 |
|
[MNA]A:1000 |
17 |
1 |
472 |
◊ |
A |
x,y,z |
1_555 |
35 |
12 |
7904 |
225.4 |
-0.5 |
0.588 |
8 |
0 |
0 |
0.000 |
5 |
|
[MNA]B:1002 |
17 |
1 |
472 |
◊ |
B |
x,y,z |
1_555 |
32 |
11 |
7721 |
223.3 |
-0.9 |
0.568 |
7 |
0 |
0 |
0.000 |
| Average: |
224.3 |
-0.7 |
0.578 |
8 |
0 |
0 |
0.000 |
| 5 |
6 |
|
[MNA]A:1001 |
17 |
1 |
469 |
f |
A |
x,y,z |
1_555 |
25 |
7 |
7904 |
183.1 |
-2.6 |
0.393 |
2 |
0 |
0 |
0.009 |
| 6 |
7 |
|
A |
18 |
6 |
7904 |
x |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
21 |
7 |
7904 |
177.3 |
0.2 |
0.649 |
4 |
1 |
0 |
0.000 |
| 7 |
8 |
|
A |
18 |
6 |
7904 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
17 |
8 |
7721 |
159.5 |
-0.6 |
0.506 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
B |
16 |
5 |
7721 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
12 |
4 |
7904 |
149.2 |
0.2 |
0.591 |
4 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[MPD]A:5001 |
6 |
1 |
278 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
7904 |
142.3 |
-8.6 |
0.737 |
0 |
0 |
0 |
0.022 |
| 10 |
11 |
|
B |
15 |
4 |
7721 |
f |
[MNA]A:1000 |
x-1,y,z |
1_455 |
11 |
1 |
472 |
103.9 |
-0.8 |
0.531 |
1 |
0 |
0 |
0.004 |
| 11 |
12 |
|
[MPD]B:5000 |
6 |
1 |
277 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
7904 |
102.3 |
-4.7 |
0.845 |
1 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[GOL]B:4000 |
6 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
18 |
4 |
7721 |
96.6 |
-0.1 |
0.628 |
1 |
0 |
0 |
0.000 |
| 13 |
14 |
|
B |
14 |
8 |
7721 |
f |
[GOL]B:4001 |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
1 |
216 |
93.2 |
-1.5 |
0.287 |
0 |
0 |
0 |
0.004 |
| 14 |
15 |
|
[SO4]A:3000 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
7904 |
92.1 |
-13.6 |
0.725 |
3 |
0 |
0 |
0.038 |
| 15 |
16 |
|
B |
8 |
4 |
7721 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
9 |
3 |
7904 |
88.2 |
-0.9 |
0.347 |
1 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[MPD]B:5000 |
5 |
1 |
277 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
7721 |
86.5 |
-4.9 |
0.661 |
1 |
0 |
0 |
0.015 |
| 17 |
18 |
|
A |
9 |
4 |
7904 |
◊ |
B |
-x+2,y-1/2,-z+1/2 |
3_745 |
10 |
5 |
7721 |
83.5 |
0.1 |
0.588 |
0 |
0 |
0 |
0.000 |
| 18 |
19 |
|
A |
10 |
5 |
7904 |
f |
[GOL]B:4000 |
-x+3/2,-y,z-1/2 |
2_654 |
6 |
1 |
219 |
83.1 |
-0.6 |
0.433 |
0 |
0 |
0 |
0.002 |
| 19 |
20 |
|
[MNA]A:1001 |
6 |
1 |
469 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
7721 |
81.0 |
2.0 |
0.839 |
2 |
0 |
0 |
0.000 |
| 20 |
21 |
|
B |
8 |
5 |
7721 |
◊ |
A |
x-1,y,z |
1_455 |
7 |
4 |
7904 |
70.9 |
-0.6 |
0.416 |
0 |
0 |
0 |
0.000 |
| 21 |
22 |
|
[SO4]B:3001 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
7721 |
68.4 |
-9.3 |
0.711 |
1 |
0 |
0 |
0.028 |
| 22 |
23 |
|
[NA]B:6001 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
3 |
3 |
7721 |
61.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.034 |
24 |
|
[NA]A:6000 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
7904 |
60.2 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.034 |
| Average: |
60.8 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.034 |
| 23 |
25 |
|
[GOL]B:4001 |
5 |
1 |
216 |
◊ |
[MNA]B:1002 |
x,y,z |
1_555 |
9 |
1 |
472 |
58.2 |
0.6 |
0.631 |
1 |
0 |
0 |
0.000 |
| 24 |
26 |
|
A |
7 |
2 |
7904 |
◊ |
[MNA]A:1001 |
-x+2,y-1/2,-z+1/2 |
3_745 |
10 |
1 |
469 |
54.7 |
0.3 |
0.486 |
1 |
0 |
0 |
0.000 |
| 25 |
27 |
|
B |
5 |
3 |
7721 |
◊ |
[MPD]B:5000 |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
1 |
277 |
45.7 |
-2.9 |
0.536 |
0 |
0 |
0 |
0.000 |
| 26 |
28 |
|
[SO4]B:3001 |
4 |
1 |
186 |
f |
[MNA]A:1000 |
x-1,y,z |
1_455 |
6 |
1 |
472 |
45.4 |
-5.5 |
0.732 |
0 |
0 |
0 |
0.015 |
| 27 |
29 |
|
B |
7 |
3 |
7721 |
◊ |
[MNA]B:1002 |
x-1/2,-y+1/2,-z+1 |
4_456 |
7 |
1 |
472 |
35.7 |
0.2 |
0.557 |
0 |
0 |
0 |
0.000 |
| 28 |
30 |
|
[MPD]B:5000 |
3 |
1 |
277 |
◊ |
[MPD]A:5001 |
x,y,z |
1_555 |
3 |
1 |
278 |
26.3 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 29 |
31 |
|
[GOL]B:4001 |
3 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
7721 |
14.7 |
-0.2 |
0.373 |
0 |
0 |
0 |
0.000 |
| 30 |
32 |
|
[MNA]A:1000 |
1 |
1 |
472 |
◊ |
[NA]A:6000 |
x,y,z |
1_555 |
1 |
1 |
125 |
4.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
|
[MNA]B:1002 |
1 |
1 |
472 |
◊ |
[NA]B:6001 |
x,y,z |
1_555 |
1 |
1 |
125 |
2.8 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
3.7 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
|