| ## |
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 |
200 |
52 |
15249 |
x |
A |
z,x,y |
5_555 |
207 |
60 |
15249 |
1937.8 |
-17.1 |
0.194 |
33 |
13 |
0 |
0.720 |
2 |
|
A |
53 |
12 |
15249 |
x |
A |
-z+1/2,-x,y+1/2 |
7_555 |
52 |
16 |
15249 |
427.0 |
-3.0 |
0.397 |
3 |
2 |
0 |
0.000 |
3 |
|
A |
42 |
12 |
15249 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
45 |
14 |
15249 |
350.4 |
-3.4 |
0.380 |
1 |
1 |
0 |
0.000 |
4 |
|
A |
27 |
11 |
15249 |
x |
A |
z-1/2,-x-1/2,-y |
6_445 |
31 |
10 |
15249 |
222.3 |
-1.8 |
0.472 |
4 |
0 |
0 |
0.000 |
5 |
|
[ACT]A:503 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
15249 |
84.9 |
-0.5 |
0.620 |
2 |
0 |
0 |
0.029 |
6 |
|
[NO2]A:508 |
3 |
1 |
149 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
15249 |
78.6 |
1.9 |
0.897 |
2 |
0 |
0 |
0.000 |
7 |
|
[NO2]A:507 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
15249 |
78.2 |
1.4 |
0.814 |
2 |
0 |
0 |
0.000 |
8 |
|
[NO2]A:506 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
15249 |
76.0 |
1.0 |
0.779 |
1 |
0 |
0 |
0.000 |
9 |
|
[NO2]A:505 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
15249 |
68.8 |
1.6 |
0.894 |
2 |
0 |
0 |
0.000 |
10 |
|
[NO2]A:504 |
3 |
1 |
147 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
15249 |
53.5 |
0.6 |
0.791 |
1 |
0 |
0 |
0.000 |
11 |
|
A |
8 |
5 |
15249 |
◊ |
[NO]A:509 |
z,x,y |
5_555 |
2 |
1 |
128 |
45.1 |
-1.7 |
0.709 |
1 |
0 |
0 |
0.045 |
12 |
|
A |
7 |
3 |
15249 |
◊ |
[NO2]A:504 |
z,x,y |
5_555 |
3 |
1 |
147 |
42.4 |
1.2 |
0.941 |
1 |
0 |
0 |
0.000 |
13 |
|
A |
9 |
4 |
15249 |
◊ |
[CU]A:502 |
z,x,y |
5_555 |
1 |
1 |
125 |
37.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.103 |
14 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
15249 |
36.9 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.122 |
15 |
|
[NO]A:509 |
2 |
1 |
128 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
15249 |
36.0 |
-1.0 |
0.549 |
0 |
0 |
0 |
0.022 |
16 |
|
A |
4 |
2 |
15249 |
f |
[NO2]A:506 |
z,x,y |
5_555 |
2 |
1 |
149 |
26.1 |
0.1 |
0.631 |
0 |
0 |
0 |
0.000 |
17 |
|
[NO]A:509 |
2 |
1 |
128 |
f |
[CU]A:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
24.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.065 |
18 |
|
A |
5 |
3 |
15249 |
f |
[NO2]A:507 |
z,x,y |
5_555 |
2 |
1 |
149 |
24.4 |
0.5 |
0.889 |
1 |
0 |
0 |
0.000 |
19 |
|
[NO2]A:505 |
2 |
1 |
149 |
f |
[NO2]A:504 |
x,y,z |
1_555 |
2 |
1 |
147 |
21.6 |
0.5 |
1.000 |
0 |
0 |
0 |
0.000 |
20 |
|
[NO2]A:505 |
3 |
1 |
149 |
◊ |
[NO2]A:504 |
z,x,y |
5_555 |
3 |
1 |
147 |
16.5 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
21 |
|
[NO2]A:505 |
3 |
1 |
149 |
f |
A |
z,x,y |
5_555 |
1 |
1 |
15249 |
5.8 |
0.2 |
0.915 |
0 |
0 |
0 |
0.000 |
22 |
|
A |
1 |
1 |
15249 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
15249 |
2.1 |
0.0 |
0.720 |
0 |
0 |
0 |
0.000 |
|