| ## |
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 |
196 |
52 |
15216 |
x |
A |
z,x,y |
5_555 |
204 |
58 |
15216 |
1933.1 |
-17.8 |
0.164 |
31 |
13 |
0 |
0.722 |
2 |
|
A |
45 |
12 |
15216 |
x |
A |
-z+1/2,-x,y+1/2 |
7_555 |
51 |
16 |
15216 |
422.6 |
-2.5 |
0.418 |
3 |
2 |
0 |
0.000 |
3 |
|
A |
41 |
12 |
15216 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
44 |
13 |
15216 |
343.9 |
-3.3 |
0.386 |
2 |
1 |
0 |
0.000 |
4 |
|
A |
27 |
10 |
15216 |
x |
A |
z-1/2,-x-1/2,-y |
6_445 |
32 |
9 |
15216 |
224.1 |
-2.1 |
0.432 |
4 |
0 |
0 |
0.000 |
5 |
|
[ACT]A:503 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
15216 |
82.8 |
-0.4 |
0.645 |
2 |
0 |
0 |
0.027 |
6 |
|
[NO2]A:508 |
3 |
1 |
148 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
15216 |
78.0 |
1.8 |
0.895 |
2 |
0 |
0 |
0.000 |
7 |
|
[NO2]A:507 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
15216 |
77.9 |
1.4 |
0.815 |
1 |
0 |
0 |
0.000 |
8 |
|
[NO2]A:506 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
15216 |
76.8 |
1.1 |
0.786 |
1 |
0 |
0 |
0.000 |
9 |
|
[NO2]A:505 |
3 |
1 |
148 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
15216 |
67.7 |
1.7 |
0.907 |
2 |
0 |
0 |
0.000 |
10 |
|
[NO2]A:504 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
15216 |
54.3 |
0.7 |
0.799 |
1 |
0 |
0 |
0.000 |
11 |
|
A |
8 |
5 |
15216 |
◊ |
[NO]A:509 |
z,x,y |
5_555 |
2 |
1 |
129 |
44.6 |
-1.7 |
0.708 |
1 |
0 |
0 |
0.047 |
12 |
|
A |
8 |
3 |
15216 |
◊ |
[NO2]A:504 |
z,x,y |
5_555 |
3 |
1 |
149 |
41.7 |
1.2 |
0.942 |
1 |
0 |
0 |
0.000 |
13 |
|
A |
9 |
4 |
15216 |
◊ |
[CU]A:502 |
z,x,y |
5_555 |
1 |
1 |
125 |
38.0 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.103 |
14 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
15216 |
37.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.124 |
15 |
|
[NO]A:509 |
2 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
15216 |
36.3 |
-1.2 |
0.560 |
0 |
0 |
0 |
0.025 |
16 |
|
A |
5 |
3 |
15216 |
f |
[NO2]A:507 |
z,x,y |
5_555 |
2 |
1 |
149 |
24.9 |
0.5 |
0.889 |
1 |
0 |
0 |
0.000 |
17 |
|
[NO]A:509 |
2 |
1 |
129 |
f |
[CU]A:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
24.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.071 |
18 |
|
A |
3 |
2 |
15216 |
f |
[NO2]A:506 |
z,x,y |
5_555 |
1 |
1 |
149 |
23.5 |
0.0 |
0.570 |
0 |
0 |
0 |
0.000 |
19 |
|
[NO2]A:505 |
2 |
1 |
148 |
f |
[NO2]A:504 |
x,y,z |
1_555 |
2 |
1 |
149 |
22.3 |
0.5 |
1.000 |
0 |
0 |
0 |
0.000 |
20 |
|
[NO2]A:505 |
2 |
1 |
148 |
◊ |
[NO2]A:504 |
z,x,y |
5_555 |
3 |
1 |
149 |
16.1 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
21 |
|
A |
1 |
1 |
15216 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
15216 |
7.9 |
0.2 |
0.779 |
0 |
0 |
0 |
0.000 |
22 |
|
[NO2]A:505 |
3 |
1 |
148 |
f |
A |
z,x,y |
5_555 |
1 |
1 |
15216 |
6.9 |
0.2 |
0.923 |
0 |
0 |
0 |
0.000 |
|