| ## |
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 |
|
A |
219 |
63 |
15518 |
x |
A |
-z-1/2,-x,y-1/2 |
7_454 |
198 |
53 |
15518 |
1970.4 |
-18.2 |
0.135 |
31 |
12 |
0 |
0.488 |
2 |
|
A |
51 |
15 |
15518 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
46 |
12 |
15518 |
466.7 |
-3.4 |
0.353 |
4 |
3 |
0 |
0.000 |
3 |
|
A |
43 |
14 |
15518 |
x |
A |
-z,x+1/2,-y+1/2 |
8_555 |
45 |
12 |
15518 |
381.5 |
-1.8 |
0.400 |
4 |
3 |
0 |
0.000 |
4 |
|
A |
40 |
11 |
15518 |
x |
A |
z,x,y |
5_555 |
32 |
10 |
15518 |
262.0 |
-0.9 |
0.586 |
4 |
2 |
0 |
0.000 |
5 |
|
[MLI]A:507 |
7 |
1 |
224 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
15518 |
120.4 |
1.8 |
0.066 |
1 |
0 |
0 |
0.000 |
6 |
|
[SO4]A:505 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
15518 |
85.3 |
-11.3 |
0.867 |
1 |
0 |
0 |
0.169 |
7 |
|
[NO2]A:506 |
3 |
1 |
145 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
15518 |
78.3 |
1.4 |
0.809 |
5 |
0 |
0 |
0.012 |
8 |
|
[SO4]A:504 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
15518 |
73.7 |
-9.9 |
0.744 |
2 |
0 |
0 |
0.155 |
9 |
|
[NO2]A:503 |
3 |
1 |
146 |
◊ |
A |
-z-1/2,-x,y-1/2 |
7_454 |
10 |
5 |
15518 |
50.9 |
0.3 |
0.624 |
2 |
0 |
0 |
0.008 |
10 |
|
[NO2]A:503 |
3 |
1 |
146 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
15518 |
41.0 |
0.2 |
0.633 |
1 |
0 |
0 |
0.004 |
11 |
|
[SO4]A:505 |
4 |
1 |
187 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
3 |
2 |
15518 |
39.4 |
-3.2 |
0.972 |
2 |
0 |
0 |
0.000 |
12 |
|
A |
4 |
2 |
15518 |
x |
A |
-x,y-1/2,-z-1/2 |
3_544 |
3 |
1 |
15518 |
37.8 |
-0.1 |
0.335 |
0 |
0 |
0 |
0.000 |
13 |
|
[CU]A:502 |
1 |
1 |
125 |
◊ |
A |
-z-1/2,-x,y-1/2 |
7_454 |
9 |
4 |
15518 |
36.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.068 |
14 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
15518 |
35.9 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.081 |
15 |
|
[NO2]A:503 |
3 |
1 |
146 |
cf |
[CU]A:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
26.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.036 |
16 |
|
[NO2]A:506 |
2 |
1 |
145 |
◊ |
A |
-z-1/2,-x,y-1/2 |
7_454 |
6 |
3 |
15518 |
25.2 |
0.5 |
0.867 |
1 |
0 |
0 |
0.000 |
17 |
|
A |
2 |
1 |
15518 |
◊ |
[SO4]A:504 |
z,x,y |
5_555 |
3 |
1 |
188 |
24.2 |
-3.1 |
0.403 |
0 |
0 |
0 |
0.000 |
18 |
|
A |
1 |
1 |
15518 |
◊ |
[SO4]A:505 |
-z,x+1/2,-y+1/2 |
8_555 |
1 |
1 |
187 |
1.2 |
-0.1 |
0.841 |
0 |
0 |
0 |
0.000 |
|