| ## |
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 |
|
A |
45 |
7 |
1374 |
◊ |
A |
y,x,-z |
7_555 |
45 |
7 |
1374 |
324.5 |
-4.6 |
0.757 |
1 |
0 |
0 |
0.059 |
| 2 |
2 |
|
B |
35 |
6 |
1209 |
◊ |
A |
x,y,z |
1_555 |
27 |
6 |
1374 |
262.6 |
-2.6 |
0.687 |
7 |
0 |
0 |
0.000 |
| 3 |
3 |
|
B |
11 |
3 |
1209 |
◊ |
A |
y,x,-z |
7_555 |
10 |
2 |
1374 |
84.0 |
0.7 |
0.745 |
0 |
0 |
0 |
0.000 |
| 4 |
4 |
|
[BGC]B:8 |
7 |
1 |
296 |
cf |
B |
x,y,z |
1_555 |
8 |
3 |
1209 |
72.1 |
-1.7 |
0.199 |
1 |
0 |
0 |
0.064 |
| 5 |
5 |
|
[RER]A:9 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
13 |
3 |
1374 |
67.9 |
-1.6 |
0.280 |
0 |
0 |
0 |
0.049 |
| 6 |
6 |
|
[BGC]A:8 |
7 |
1 |
293 |
cf |
A |
x,y,z |
1_555 |
8 |
3 |
1374 |
63.7 |
-0.6 |
0.199 |
0 |
0 |
0 |
0.017 |
| 7 |
7 |
|
A |
11 |
3 |
1374 |
◊ |
B |
-y+1/2,x+1/2,z-1/4 |
3_554 |
10 |
1 |
1209 |
62.3 |
-2.1 |
0.405 |
0 |
0 |
0 |
0.064 |
| 8 |
8 |
|
B |
6 |
1 |
1209 |
◊ |
A |
y-1,x,-z |
7_455 |
11 |
1 |
1374 |
62.2 |
-1.3 |
0.432 |
0 |
0 |
0 |
0.030 |
| 9 |
9 |
|
B |
10 |
3 |
1209 |
◊ |
[RER]A:9 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
4 |
1 |
295 |
61.1 |
0.3 |
0.411 |
0 |
0 |
0 |
0.000 |
| 10 |
10 |
|
B |
7 |
2 |
1209 |
◊ |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
13 |
2 |
1374 |
60.5 |
-2.6 |
0.377 |
0 |
0 |
0 |
0.008 |
| 11 |
11 |
|
[CL]B:22 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
1209 |
58.8 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.444 |
12 |
|
[CL]A:21 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
4 |
1374 |
47.1 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.444 |
| Average: |
53.0 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.444 |
| 12 |
13 |
|
[RER]A:9 |
6 |
1 |
295 |
cf |
[BGC]A:8 |
x,y,z |
1_555 |
5 |
1 |
293 |
58.5 |
2.4 |
0.337 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[BGC]A:8 |
6 |
1 |
293 |
◊ |
B |
x,y,z |
1_555 |
10 |
2 |
1209 |
53.6 |
0.9 |
0.374 |
0 |
0 |
0 |
0.000 |
| 14 |
15 |
|
B |
9 |
2 |
1209 |
◊ |
[RER]B:9 |
-y+1/2,x+1/2,z-1/4 |
3_554 |
5 |
1 |
296 |
53.1 |
1.4 |
0.591 |
0 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[CL]A:22 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
1374 |
52.8 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.225 |
| 16 |
17 |
|
[RER]B:9 |
6 |
1 |
296 |
f |
B |
x,y,z |
1_555 |
14 |
3 |
1209 |
52.3 |
-1.2 |
0.332 |
0 |
0 |
0 |
0.037 |
| 17 |
18 |
|
[RER]B:9 |
6 |
1 |
296 |
cf |
[BGC]B:8 |
x,y,z |
1_555 |
5 |
1 |
296 |
48.8 |
1.9 |
0.326 |
0 |
0 |
0 |
0.000 |
| 18 |
19 |
|
A |
8 |
2 |
1374 |
◊ |
[RER]B:9 |
-y+1/2,x+1/2,z-1/4 |
3_554 |
4 |
1 |
296 |
44.2 |
-0.3 |
0.369 |
0 |
0 |
0 |
0.008 |
| 19 |
20 |
|
B |
4 |
2 |
1209 |
◊ |
[BGC]B:8 |
-y+1/2,x+1/2,z-1/4 |
3_554 |
4 |
1 |
296 |
39.1 |
0.9 |
0.437 |
0 |
0 |
0 |
0.000 |
| 20 |
21 |
|
[RER]B:9 |
3 |
1 |
296 |
◊ |
[BGC]A:8 |
x,y,z |
1_555 |
6 |
1 |
293 |
36.6 |
1.1 |
0.259 |
0 |
0 |
0 |
0.000 |
| 21 |
22 |
|
[RER]B:9 |
3 |
1 |
296 |
◊ |
[RER]A:9 |
x,y,z |
1_555 |
4 |
1 |
295 |
32.5 |
0.7 |
0.349 |
0 |
0 |
0 |
0.000 |
| 22 |
23 |
|
B |
7 |
2 |
1209 |
◊ |
[CL]B:21 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
1 |
1 |
125 |
31.8 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.074 |
| 23 |
24 |
|
[CL]A:22 |
1 |
1 |
125 |
◊ |
A |
y,x,-z |
7_555 |
1 |
1 |
1374 |
29.2 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.125 |
25 |
|
B |
3 |
1 |
1209 |
◊ |
[CL]A:22 |
y-1,x,-z |
7_455 |
1 |
1 |
125 |
17.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.125 |
| Average: |
23.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.125 |
| 24 |
26 |
|
[CL]B:21 |
1 |
1 |
125 |
◊ |
[RER]A:9 |
x,y,z |
1_555 |
3 |
1 |
295 |
28.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 25 |
27 |
|
[BGC]B:8 |
6 |
1 |
296 |
◊ |
[BGC]A:8 |
x,y,z |
1_555 |
4 |
1 |
293 |
27.7 |
0.7 |
0.126 |
0 |
0 |
0 |
0.000 |
| 26 |
28 |
|
A |
6 |
1 |
1374 |
f |
[CL]B:21 |
-y+1/2,x+1/2,z-1/4 |
3_554 |
1 |
1 |
125 |
27.4 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.105 |
| 27 |
29 |
|
B |
5 |
2 |
1209 |
◊ |
[CL]A:21 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
1 |
1 |
125 |
27.3 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.010 |
| 28 |
30 |
|
[BGC]B:8 |
4 |
1 |
296 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
1374 |
27.2 |
-0.1 |
0.143 |
0 |
0 |
0 |
0.000 |
| 29 |
31 |
|
[RER]A:9 |
2 |
1 |
295 |
◊ |
A |
y,x,-z |
7_555 |
5 |
1 |
1374 |
26.4 |
0.8 |
0.575 |
0 |
0 |
0 |
0.000 |
| 30 |
32 |
|
[RER]B:9 |
3 |
1 |
296 |
◊ |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
3 |
1 |
1374 |
25.3 |
0.1 |
0.433 |
0 |
0 |
0 |
0.000 |
| 31 |
33 |
|
[CL]A:21 |
1 |
1 |
125 |
◊ |
A |
y,x,-z |
7_555 |
3 |
2 |
1374 |
25.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.071 |
| 32 |
34 |
|
[CL]B:21 |
1 |
1 |
125 |
◊ |
[RER]B:9 |
x,y,z |
1_555 |
4 |
1 |
296 |
22.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.074 |
| 33 |
35 |
|
[RER]B:9 |
1 |
1 |
296 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
1374 |
21.9 |
0.5 |
0.627 |
0 |
0 |
0 |
0.000 |
| 34 |
36 |
|
B |
1 |
1 |
1209 |
x |
B |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
1 |
1 |
1209 |
12.1 |
-1.3 |
0.080 |
0 |
0 |
0 |
0.000 |
| 35 |
37 |
|
[CL]A:22 |
1 |
1 |
125 |
◊ |
[CL]A:22 |
y,x,-z |
7_555 |
1 |
1 |
125 |
9.7 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.023 |
| 36 |
38 |
|
[BGC]B:8 |
2 |
1 |
296 |
◊ |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
1 |
1 |
1374 |
9.2 |
0.3 |
0.450 |
0 |
0 |
0 |
0.000 |
| 37 |
39 |
|
[CL]B:21 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
1209 |
7.3 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.044 |
| 38 |
40 |
|
B |
1 |
1 |
1209 |
◊ |
[RER]B:9 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
2 |
1 |
296 |
7.3 |
0.0 |
0.345 |
0 |
0 |
0 |
0.000 |
| 39 |
41 |
|
[CL]B:21 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
1374 |
4.8 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 40 |
42 |
|
A |
2 |
2 |
1374 |
x |
A |
-y+1/2,x+1/2,z-1/4 |
3_554 |
2 |
1 |
1374 |
3.7 |
0.0 |
0.601 |
0 |
0 |
0 |
0.000 |
| 41 |
43 |
|
[RER]B:9 |
1 |
1 |
296 |
◊ |
[CL]A:21 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
1 |
1 |
125 |
2.7 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.001 |
| 42 |
44 |
|
[CL]B:21 |
1 |
1 |
125 |
◊ |
[BGC]A:8 |
x,y,z |
1_555 |
1 |
1 |
293 |
2.2 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 43 |
45 |
|
[RER]A:9 |
1 |
1 |
295 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
1209 |
1.2 |
-0.1 |
0.322 |
0 |
0 |
0 |
0.000 |
| 44 |
46 |
|
B |
1 |
1 |
1209 |
◊ |
[BGC]A:8 |
y-1,x,-z |
7_455 |
1 |
1 |
293 |
0.4 |
0.0 |
0.330 |
0 |
0 |
0 |
0.000 |
| 45 |
47 |
|
B |
1 |
1 |
1209 |
◊ |
[CL]B:21 |
-y+1/2,x+1/2,z-1/4 |
3_554 |
1 |
1 |
125 |
0.1 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|