## |
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 |
53 |
15 |
15585 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
47 |
15 |
15805 |
470.0 |
-6.8 |
0.172 |
2 |
0 |
0 |
0.000 |
2 |
2 |
|
B |
51 |
16 |
15585 |
◊ |
A |
x,y,z |
1_555 |
44 |
12 |
15805 |
404.0 |
-0.8 |
0.583 |
4 |
3 |
0 |
0.000 |
3 |
3 |
|
[KC6]B:503 |
21 |
1 |
490 |
f |
B |
x,y,z |
1_555 |
51 |
18 |
15585 |
310.4 |
-6.6 |
0.539 |
6 |
0 |
0 |
0.026 |
4 |
|
[KC6]A:503 |
21 |
1 |
491 |
f |
A |
x,y,z |
1_555 |
50 |
19 |
15805 |
308.8 |
-6.3 |
0.577 |
4 |
0 |
0 |
0.026 |
Average: |
309.6 |
-6.4 |
0.558 |
5 |
0 |
0 |
0.026 |
4 |
5 |
|
B |
25 |
9 |
15585 |
◊ |
A |
-x-1/2,y-1/2,-z |
3_445 |
25 |
9 |
15805 |
235.9 |
-0.5 |
0.598 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
A |
16 |
5 |
15805 |
◊ |
B |
x,y,z-1 |
1_554 |
17 |
4 |
15585 |
147.9 |
-1.5 |
0.422 |
1 |
0 |
0 |
0.000 |
6 |
7 |
|
B |
12 |
5 |
15585 |
◊ |
A |
x-1/2,-y-1/2,-z-1 |
4_444 |
14 |
6 |
15805 |
107.2 |
-0.6 |
0.488 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
[CL]A:505 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
15805 |
75.2 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.017 |
8 |
9 |
|
[CL]A:360 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
15805 |
64.9 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.018 |
9 |
10 |
|
[CL]A:506 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
15805 |
60.8 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.012 |
10 |
11 |
|
[CL]B:504 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
15585 |
60.6 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.026 |
12 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
15805 |
59.4 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.026 |
Average: |
60.0 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.026 |
11 |
13 |
|
A |
8 |
2 |
15805 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
6 |
1 |
15585 |
58.9 |
-1.4 |
0.232 |
0 |
0 |
0 |
0.000 |
12 |
14 |
|
[NA]A:507 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
15805 |
53.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.016 |
15 |
|
[NA]B:506 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
15585 |
47.6 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.016 |
Average: |
50.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.016 |
13 |
16 |
|
[NI]B:501 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
15585 |
42.6 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.020 |
17 |
|
[NI]A:501 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
15805 |
42.6 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.020 |
Average: |
42.6 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.020 |
14 |
18 |
|
[KC6]B:503 |
5 |
1 |
490 |
f |
[NI]B:501 |
x,y,z |
1_555 |
1 |
1 |
115 |
40.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.013 |
19 |
|
[KC6]A:503 |
5 |
1 |
491 |
f |
[NI]A:501 |
x,y,z |
1_555 |
1 |
1 |
115 |
40.5 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.013 |
Average: |
40.6 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.013 |
15 |
20 |
|
A |
6 |
2 |
15805 |
◊ |
A |
-x-1,-y,z |
2_455 |
5 |
2 |
15805 |
36.5 |
-0.2 |
0.568 |
0 |
0 |
0 |
0.000 |
16 |
21 |
|
[CL]A:506 |
1 |
1 |
125 |
◊ |
B |
x,y,z-1 |
1_554 |
5 |
2 |
15585 |
28.3 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.000 |
17 |
22 |
|
A |
4 |
3 |
15805 |
x |
A |
x-1/2,-y-1/2,-z-1 |
4_444 |
3 |
2 |
15805 |
24.4 |
-0.5 |
0.334 |
0 |
0 |
0 |
0.000 |
18 |
23 |
|
B |
4 |
2 |
15585 |
◊ |
B |
-x-1,-y-1,z |
2_445 |
4 |
2 |
15585 |
18.4 |
-0.3 |
0.502 |
0 |
0 |
0 |
0.000 |
19 |
24 |
|
B |
3 |
1 |
15585 |
◊ |
[CL]A:504 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
125 |
17.2 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
|
[CL]B:504 |
1 |
1 |
125 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
15805 |
3.4 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
10.3 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
|