## |
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 |
|
B |
86 |
22 |
8049 |
◊ |
A |
x,y,z |
1_555 |
80 |
19 |
7897 |
821.6 |
-11.4 |
0.270 |
4 |
2 |
0 |
0.514 |
2 |
|
B |
50 |
14 |
8049 |
◊ |
A |
x,x-y+1,-z-1/6 |
12_564 |
61 |
16 |
7897 |
593.3 |
-8.7 |
0.258 |
3 |
2 |
0 |
0.593 |
3 |
|
B |
53 |
15 |
8049 |
◊ |
A |
-y,-x,-z-5/6 |
10_554 |
62 |
15 |
7897 |
539.4 |
-9.2 |
0.194 |
2 |
7 |
0 |
0.422 |
4 |
|
B |
32 |
10 |
8049 |
◊ |
B |
-x,-x+y,-z-2/3 |
9_554 |
32 |
10 |
8049 |
345.5 |
-1.7 |
0.667 |
1 |
2 |
0 |
0.000 |
5 |
|
A |
29 |
9 |
7897 |
◊ |
A |
-x+y-1,y,-z-1/2 |
11_454 |
28 |
9 |
7897 |
275.1 |
-3.9 |
0.380 |
1 |
0 |
1 |
0.000 |
6 |
|
B |
20 |
6 |
8049 |
◊ |
B |
-y,-x,-z+1/6 |
10_555 |
20 |
6 |
8049 |
173.1 |
-3.3 |
0.361 |
0 |
0 |
0 |
0.000 |
7 |
|
[MPD]A:201 |
7 |
1 |
278 |
f |
A |
x,y,z |
1_555 |
28 |
7 |
7897 |
163.3 |
-10.7 |
0.711 |
1 |
0 |
0 |
0.637 |
8 |
|
A |
19 |
6 |
7897 |
◊ |
B |
x-y,x,z-1/6 |
6_554 |
16 |
6 |
8049 |
151.8 |
1.8 |
0.783 |
1 |
1 |
0 |
0.000 |
9 |
|
A |
11 |
6 |
7897 |
◊ |
A |
-y,-x,-z-5/6 |
10_554 |
11 |
6 |
7897 |
141.5 |
-6.4 |
0.006 |
0 |
0 |
0 |
0.122 |
10 |
|
A |
11 |
4 |
7897 |
x |
A |
x-y,x,z-1/6 |
6_554 |
13 |
4 |
7897 |
124.1 |
0.6 |
0.748 |
0 |
3 |
0 |
0.000 |
11 |
|
[EDO]A:202 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
18 |
7 |
8049 |
100.5 |
1.4 |
0.255 |
0 |
0 |
0 |
0.000 |
12 |
|
B |
10 |
3 |
8049 |
◊ |
A |
-y,x-y+1,z+2/3 |
2_565 |
9 |
4 |
7897 |
94.5 |
-0.9 |
0.498 |
0 |
0 |
0 |
0.000 |
13 |
|
[EDO]B:204 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
8049 |
84.6 |
2.9 |
0.520 |
0 |
0 |
0 |
0.000 |
14 |
|
[EDO]A:204 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
7897 |
79.4 |
1.8 |
0.251 |
0 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:203 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
7897 |
78.6 |
1.6 |
0.804 |
0 |
0 |
0 |
0.000 |
16 |
|
A |
6 |
3 |
7897 |
◊ |
A |
x-y,-y,-z-1 |
8_554 |
6 |
3 |
7897 |
77.3 |
-1.3 |
0.319 |
0 |
0 |
0 |
0.000 |
17 |
|
[EDO]B:205 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
8049 |
76.1 |
1.1 |
0.768 |
2 |
0 |
0 |
0.000 |
18 |
|
[EDO]B:202 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
8049 |
69.6 |
1.3 |
0.266 |
0 |
0 |
0 |
0.000 |
19 |
|
[MPD]B:201 |
5 |
1 |
282 |
f |
[MPD]B:201 |
x,x-y+1,-z-1/6 |
12_564 |
5 |
1 |
282 |
68.3 |
-6.6 |
1.000 |
0 |
0 |
0 |
0.100 |
20 |
|
[EDO]B:202 |
4 |
1 |
185 |
f |
A |
-y,x-y+1,z+2/3 |
2_565 |
11 |
4 |
7897 |
65.2 |
0.7 |
0.610 |
1 |
0 |
0 |
0.000 |
21 |
|
[EDO]B:203 |
3 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
8049 |
63.0 |
2.2 |
0.630 |
0 |
0 |
0 |
0.000 |
22 |
|
[EDO]A:202 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
7897 |
62.0 |
1.7 |
0.844 |
0 |
0 |
0 |
0.000 |
23 |
|
[EDO]B:203 |
4 |
1 |
184 |
◊ |
A |
-y,-x,-z-5/6 |
10_554 |
7 |
3 |
7897 |
47.1 |
0.9 |
0.622 |
0 |
0 |
0 |
0.000 |
24 |
|
[MPD]A:201 |
2 |
1 |
278 |
◊ |
B |
x,x-y+1,-z-1/6 |
12_564 |
5 |
1 |
8049 |
41.7 |
-2.0 |
0.813 |
0 |
0 |
0 |
0.117 |
25 |
|
[EDO]B:202 |
3 |
1 |
185 |
◊ |
A |
x,x-y+1,-z-1/6 |
12_564 |
7 |
4 |
7897 |
37.0 |
0.7 |
0.653 |
0 |
0 |
0 |
0.000 |
26 |
|
[EDO]B:203 |
4 |
1 |
184 |
◊ |
[EDO]A:204 |
x,y,z |
1_555 |
3 |
1 |
184 |
35.6 |
1.4 |
1.000 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:203 |
3 |
1 |
185 |
◊ |
B |
x,x-y+1,-z-1/6 |
12_564 |
2 |
2 |
8049 |
33.4 |
0.5 |
0.394 |
0 |
0 |
0 |
0.000 |
28 |
|
[EDO]B:203 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
7897 |
32.9 |
0.5 |
0.816 |
0 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:204 |
3 |
1 |
184 |
f |
A |
-y,-x,-z-5/6 |
10_554 |
4 |
2 |
7897 |
26.8 |
-0.1 |
0.487 |
0 |
0 |
0 |
0.006 |
30 |
|
[MPD]B:201 |
1 |
1 |
282 |
◊ |
B |
x,x-y+1,-z-1/6 |
12_564 |
1 |
1 |
8049 |
14.4 |
-0.4 |
0.936 |
0 |
0 |
0 |
0.000 |
31 |
|
[EDO]A:204 |
2 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
8049 |
12.5 |
0.1 |
0.786 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
2 |
1 |
7897 |
f |
[EDO]A:202 |
x-y,x,z-1/6 |
6_554 |
2 |
1 |
184 |
9.0 |
0.4 |
0.866 |
0 |
0 |
0 |
0.000 |
33 |
|
[EDO]A:203 |
3 |
1 |
185 |
f |
[MPD]A:201 |
x,y,z |
1_555 |
1 |
1 |
278 |
5.7 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.011 |
34 |
|
B |
2 |
2 |
8049 |
◊ |
B |
x,x-y+1,-z-1/6 |
12_564 |
2 |
2 |
8049 |
1.3 |
-0.0 |
0.673 |
0 |
0 |
0 |
0.000 |
35 |
|
[EDO]A:204 |
1 |
1 |
184 |
◊ |
B |
x,x-y+1,-z-1/6 |
12_564 |
1 |
1 |
8049 |
1.1 |
0.1 |
0.884 |
0 |
0 |
0 |
0.000 |
|