| ## |
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 |
117 |
30 |
6951 |
◊ |
A |
-x+1,y,-z+2 |
2_657 |
115 |
30 |
6951 |
1163.7 |
-20.5 |
0.042 |
14 |
2 |
0 |
0.260 |
2 |
|
B |
118 |
30 |
6804 |
◊ |
B |
-x+1,y,-z+2 |
2_657 |
118 |
30 |
6804 |
1162.1 |
-20.4 |
0.064 |
14 |
2 |
0 |
0.260 |
| Average: |
1162.9 |
-20.5 |
0.053 |
14 |
2 |
0 |
0.260 |
| 2 |
3 |
|
B |
75 |
25 |
6804 |
◊ |
A |
x,y,z |
1_555 |
76 |
25 |
6951 |
640.9 |
-8.4 |
0.310 |
8 |
0 |
0 |
0.092 |
| 3 |
4 |
|
A |
50 |
14 |
6951 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
51 |
14 |
6804 |
496.0 |
1.6 |
0.910 |
5 |
7 |
0 |
0.000 |
| 4 |
5 |
|
B |
38 |
12 |
6804 |
◊ |
A |
-x+1,y,-z+2 |
2_657 |
37 |
12 |
6951 |
373.5 |
-9.8 |
0.023 |
0 |
0 |
0 |
0.108 |
| 5 |
6 |
|
A |
28 |
8 |
6951 |
◊ |
A |
-x+1,y,-z+3 |
2_658 |
28 |
8 |
6951 |
254.1 |
4.1 |
0.965 |
10 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
33 |
10 |
6804 |
◊ |
A |
-x+3/2,y-1/2,-z+3 |
4_648 |
24 |
8 |
6951 |
250.9 |
0.3 |
0.776 |
1 |
1 |
0 |
0.000 |
| 7 |
8 |
|
[THU]A:138 |
15 |
1 |
378 |
f |
A |
x,y,z |
1_555 |
26 |
13 |
6951 |
189.6 |
0.5 |
0.295 |
3 |
0 |
0 |
0.017 |
9 |
|
[THU]B:138 |
15 |
1 |
379 |
f |
B |
x,y,z |
1_555 |
27 |
14 |
6804 |
189.5 |
0.6 |
0.322 |
3 |
0 |
0 |
0.017 |
| Average: |
189.5 |
0.6 |
0.308 |
3 |
0 |
0 |
0.017 |
| 8 |
10 |
|
[THU]A:138 |
7 |
1 |
378 |
◊ |
B |
-x+1,y,-z+2 |
2_657 |
13 |
4 |
6804 |
59.6 |
0.4 |
0.407 |
2 |
0 |
0 |
0.011 |
11 |
|
[THU]B:138 |
7 |
1 |
379 |
◊ |
A |
-x+1,y,-z+2 |
2_657 |
13 |
4 |
6951 |
59.0 |
0.4 |
0.393 |
2 |
0 |
0 |
0.011 |
| Average: |
59.3 |
0.4 |
0.400 |
2 |
0 |
0 |
0.011 |
| 9 |
12 |
|
[THU]B:138 |
6 |
1 |
379 |
◊ |
A |
x,y,z |
1_555 |
9 |
2 |
6951 |
56.9 |
0.5 |
0.340 |
0 |
0 |
0 |
0.000 |
13 |
|
[THU]A:138 |
6 |
1 |
378 |
◊ |
B |
x,y,z |
1_555 |
9 |
2 |
6804 |
55.8 |
0.5 |
0.361 |
0 |
0 |
0 |
0.000 |
| Average: |
56.4 |
0.5 |
0.351 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[ZN]A:1131 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
6951 |
34.6 |
-25.9 |
0.000 |
0 |
0 |
0 |
0.570 |
15 |
|
[ZN]B:1131 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
6804 |
34.4 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.570 |
| Average: |
34.5 |
-25.9 |
0.000 |
0 |
0 |
0 |
0.570 |
| 11 |
16 |
|
[ZN]A:1131 |
1 |
1 |
98 |
f |
[THU]A:138 |
x,y,z |
1_555 |
5 |
1 |
378 |
25.3 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.260 |
17 |
|
[ZN]B:1131 |
1 |
1 |
98 |
f |
[THU]B:138 |
x,y,z |
1_555 |
5 |
1 |
379 |
25.3 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.260 |
| Average: |
25.3 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.260 |
| 12 |
18 |
|
[ZN]B:1131 |
1 |
1 |
98 |
◊ |
A |
-x+1,y,-z+2 |
2_657 |
3 |
3 |
6951 |
4.2 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.035 |
19 |
|
[ZN]A:1131 |
1 |
1 |
98 |
◊ |
B |
-x+1,y,-z+2 |
2_657 |
3 |
3 |
6804 |
4.2 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.035 |
| Average: |
4.2 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.035 |
|