| ## |
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 |
116 |
26 |
4912 |
◊ |
A |
x,y,z |
1_555 |
122 |
38 |
10786 |
1105.8 |
-9.3 |
0.238 |
16 |
9 |
0 |
0.375 |
2 |
|
A |
79 |
24 |
10786 |
◊ |
A |
-x,-y,z |
2_555 |
80 |
25 |
10786 |
597.5 |
-2.4 |
0.591 |
4 |
4 |
0 |
0.000 |
3 |
|
B |
50 |
20 |
4912 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
48 |
15 |
10786 |
415.9 |
0.7 |
0.728 |
7 |
1 |
0 |
0.000 |
4 |
|
A |
34 |
13 |
10786 |
◊ |
B |
x,y,z-1 |
1_554 |
37 |
12 |
4912 |
339.6 |
-0.7 |
0.495 |
6 |
4 |
0 |
0.000 |
5 |
|
A |
21 |
10 |
10786 |
◊ |
A |
-x-1,-y,z |
2_455 |
21 |
10 |
10786 |
220.9 |
-1.7 |
0.397 |
7 |
2 |
0 |
0.000 |
6 |
|
A |
16 |
6 |
10786 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
13 |
5 |
10786 |
116.8 |
-0.2 |
0.542 |
0 |
0 |
0 |
0.000 |
7 |
|
B |
14 |
4 |
4912 |
◊ |
A |
-x-1/2,y-1/2,-z+1 |
3_446 |
12 |
5 |
10786 |
113.3 |
-0.6 |
0.529 |
1 |
0 |
0 |
0.000 |
8 |
|
[NO3]A:504 |
4 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
10786 |
92.0 |
1.6 |
0.764 |
4 |
0 |
0 |
0.005 |
9 |
|
[NO3]A:507 |
4 |
1 |
158 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
10786 |
85.8 |
0.5 |
0.388 |
4 |
0 |
0 |
0.026 |
10 |
|
[NO3]A:506 |
4 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
10786 |
81.3 |
1.1 |
0.575 |
3 |
0 |
0 |
0.005 |
11 |
|
[NO3]B:505 |
4 |
1 |
158 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
4912 |
77.4 |
1.8 |
0.679 |
4 |
0 |
0 |
0.000 |
12 |
|
[NO3]B:503 |
4 |
1 |
158 |
◊ |
B |
x,y,z |
1_555 |
13 |
6 |
4912 |
77.4 |
1.4 |
0.616 |
3 |
0 |
0 |
0.000 |
13 |
|
[CU]B:501 |
1 |
1 |
125 |
cf |
B |
x,y,z |
1_555 |
6 |
4 |
4912 |
57.5 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.230 |
14 |
|
[CU]A:500 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
10786 |
57.3 |
-13.3 |
0.000 |
0 |
0 |
0 |
0.280 |
15 |
|
[NO3]B:505 |
4 |
1 |
158 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
9 |
5 |
10786 |
52.2 |
0.3 |
0.365 |
0 |
0 |
0 |
0.000 |
16 |
|
B |
9 |
4 |
4912 |
◊ |
[NO3]A:506 |
-x-1/2,y-1/2,-z+1 |
3_446 |
4 |
1 |
159 |
41.8 |
0.3 |
0.736 |
0 |
0 |
0 |
0.000 |
17 |
|
[NO3]B:503 |
4 |
1 |
158 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
10786 |
30.6 |
0.1 |
0.625 |
0 |
0 |
0 |
0.000 |
18 |
|
A |
5 |
2 |
10786 |
◊ |
B |
x-1/2,-y-1/2,-z+1 |
4_446 |
3 |
1 |
4912 |
28.2 |
-0.6 |
0.337 |
0 |
0 |
0 |
0.000 |
19 |
|
[CU]A:500 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
4912 |
23.6 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.053 |
20 |
|
[CU]A:502 |
1 |
1 |
125 |
x |
A |
x,y,z |
1_555 |
2 |
1 |
10786 |
17.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
21 |
|
[CU]B:501 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
10786 |
15.5 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.032 |
|