| ## |
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 |
46 |
13 |
2561 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
39 |
12 |
2142 |
455.4 |
-9.4 |
0.136 |
1 |
0 |
0 |
0.124 |
| 2 |
2 |
|
B |
37 |
9 |
2561 |
◊ |
A |
x,y,z |
1_555 |
40 |
11 |
2142 |
370.3 |
-5.6 |
0.340 |
3 |
0 |
1 |
0.112 |
| 3 |
3 |
|
B |
24 |
7 |
2561 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
24 |
7 |
2561 |
234.1 |
-2.6 |
0.565 |
0 |
0 |
0 |
0.012 |
| 4 |
4 |
|
B |
20 |
4 |
2561 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
23 |
7 |
2142 |
188.8 |
-1.8 |
0.586 |
1 |
0 |
0 |
0.022 |
| 5 |
5 |
|
B |
17 |
5 |
2561 |
◊ |
B |
-x,y,-z-1/2 |
3_554 |
17 |
5 |
2561 |
137.3 |
0.6 |
0.821 |
4 |
0 |
0 |
0.006 |
| 6 |
6 |
|
A |
17 |
5 |
2142 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
17 |
5 |
2142 |
133.6 |
-0.1 |
0.750 |
2 |
2 |
0 |
0.013 |
| 7 |
7 |
|
A |
7 |
2 |
2142 |
◊ |
A |
x,-y+1,-z |
4_565 |
7 |
2 |
2142 |
81.3 |
-2.1 |
0.204 |
0 |
0 |
0 |
0.000 |
| 8 |
8 |
|
B |
7 |
2 |
2561 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
11 |
3 |
2142 |
77.6 |
-0.3 |
0.615 |
0 |
0 |
0 |
0.000 |
| 9 |
9 |
|
B |
5 |
1 |
2561 |
x |
B |
x-1/2,-y+1/2,-z |
8_455 |
8 |
2 |
2561 |
56.9 |
1.0 |
0.816 |
0 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[ZN]A:51 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
6 |
2142 |
51.0 |
-38.1 |
0.000 |
0 |
0 |
0 |
0.814 |
11 |
|
[ZN]B:51 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
2561 |
36.6 |
-26.7 |
0.000 |
0 |
0 |
0 |
0.814 |
| Average: |
43.8 |
-32.4 |
0.000 |
0 |
0 |
0 |
0.814 |
| 11 |
12 |
|
[NA]A:52 |
1 |
1 |
125 |
x |
A |
x,y,z |
1_555 |
10 |
3 |
2142 |
50.6 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.120 |
| 12 |
13 |
|
A |
6 |
2 |
2142 |
x |
A |
x-1/2,-y+1/2,-z |
8_455 |
6 |
1 |
2142 |
48.0 |
-0.2 |
0.518 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[NA]B:52 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
2142 |
44.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.100 |
| 14 |
15 |
|
B |
5 |
3 |
2561 |
◊ |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
5 |
3 |
2142 |
42.6 |
0.1 |
0.621 |
0 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[NA]B:52 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
2561 |
39.4 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.042 |
| 16 |
17 |
|
[ZN]B:51 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
2142 |
27.8 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.131 |
| 17 |
18 |
|
A |
6 |
2 |
2142 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
6 |
2 |
2142 |
27.7 |
-0.2 |
0.620 |
0 |
0 |
0 |
0.001 |
| 18 |
19 |
|
[NA]B:52 |
1 |
1 |
125 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
5 |
2 |
2561 |
24.6 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.023 |
| 19 |
20 |
|
B |
2 |
1 |
2561 |
◊ |
B |
x,-y,-z |
4_555 |
2 |
1 |
2561 |
4.7 |
-0.2 |
0.565 |
0 |
0 |
0 |
0.000 |
| 20 |
21 |
|
[NA]B:52 |
1 |
1 |
125 |
◊ |
[NA]B:52 |
-x,y,-z+1/2 |
3_555 |
1 |
1 |
125 |
3.9 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.004 |
| 21 |
22 |
|
B |
1 |
1 |
2561 |
◊ |
A |
x,-y+1,-z |
4_565 |
1 |
1 |
2142 |
0.9 |
0.0 |
0.703 |
0 |
0 |
0 |
0.000 |
|