| ## |
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 |
|
[HKL]A:154 |
40 |
1 |
813 |
f |
A |
x,y,z |
1_555 |
60 |
22 |
8087 |
492.7 |
-2.9 |
0.172 |
0 |
0 |
0 |
0.007 |
2 |
|
A |
41 |
9 |
8087 |
x |
A |
-x,y-1/2,-z |
2_545 |
52 |
15 |
8087 |
425.0 |
0.7 |
0.766 |
5 |
3 |
0 |
0.000 |
3 |
|
A |
39 |
11 |
8087 |
x |
A |
x-1,y,z |
1_455 |
37 |
10 |
8087 |
330.9 |
-1.4 |
0.545 |
3 |
2 |
0 |
0.000 |
4 |
|
A |
33 |
14 |
8087 |
x |
A |
x,y-1,z |
1_545 |
35 |
13 |
8087 |
271.9 |
-3.6 |
0.299 |
0 |
1 |
0 |
0.000 |
5 |
|
A |
20 |
5 |
8087 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
22 |
9 |
8087 |
179.9 |
-0.2 |
0.592 |
1 |
2 |
0 |
0.000 |
6 |
|
A |
16 |
5 |
8087 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
14 |
4 |
8087 |
139.2 |
-2.8 |
0.180 |
0 |
0 |
0 |
0.000 |
7 |
|
[HKL]A:154 |
10 |
1 |
813 |
◊ |
A |
x,y-1,z |
1_545 |
11 |
4 |
8087 |
103.5 |
-1.3 |
0.360 |
0 |
0 |
0 |
0.000 |
8 |
|
[SO4]A:159 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
8087 |
88.2 |
-12.9 |
0.604 |
4 |
0 |
0 |
0.037 |
9 |
|
[NO2]A:157 |
3 |
1 |
146 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
8087 |
84.9 |
1.7 |
0.874 |
2 |
0 |
0 |
0.000 |
10 |
|
[SO4]A:158 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
8087 |
78.8 |
-11.8 |
0.709 |
3 |
0 |
0 |
0.033 |
11 |
|
[NO2]A:155 |
3 |
1 |
145 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
8087 |
69.8 |
1.0 |
0.809 |
1 |
0 |
0 |
0.000 |
12 |
|
[SO4]A:158 |
4 |
1 |
184 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
9 |
5 |
8087 |
53.7 |
-7.3 |
0.648 |
1 |
0 |
0 |
0.000 |
13 |
|
[NO2]A:156 |
3 |
1 |
146 |
◊ |
A |
x,y-1,z |
1_545 |
7 |
4 |
8087 |
45.8 |
0.0 |
0.582 |
1 |
0 |
0 |
0.000 |
14 |
|
[NO2]A:155 |
3 |
1 |
145 |
f |
[HKL]A:154 |
x,y,z |
1_555 |
21 |
1 |
813 |
45.3 |
0.2 |
0.576 |
0 |
0 |
0 |
0.000 |
15 |
|
[NO2]A:156 |
3 |
1 |
146 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
8087 |
42.8 |
-0.2 |
0.405 |
0 |
0 |
0 |
0.000 |
16 |
|
[NA]A:160 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
8087 |
41.4 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.014 |
17 |
|
A |
8 |
4 |
8087 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
9 |
5 |
8087 |
38.6 |
0.3 |
0.687 |
0 |
0 |
0 |
0.000 |
18 |
|
[NO2]A:156 |
3 |
1 |
146 |
f |
[HKL]A:154 |
x,y,z |
1_555 |
6 |
1 |
813 |
36.0 |
0.5 |
0.705 |
0 |
0 |
0 |
0.000 |
19 |
|
[SO4]A:159 |
3 |
1 |
185 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
4 |
1 |
8087 |
32.7 |
-3.9 |
0.844 |
0 |
0 |
0 |
0.000 |
20 |
|
[NA]A:160 |
1 |
1 |
125 |
f |
[HKL]A:154 |
x,y,z |
1_555 |
8 |
1 |
813 |
30.3 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.009 |
21 |
|
A |
2 |
1 |
8087 |
f |
[NO2]A:157 |
x,y-1,z |
1_545 |
2 |
1 |
146 |
30.3 |
0.3 |
0.671 |
0 |
0 |
0 |
0.000 |
22 |
|
[NA]A:160 |
1 |
1 |
125 |
◊ |
A |
x,y-1,z |
1_545 |
3 |
2 |
8087 |
25.7 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.000 |
23 |
|
[NA]A:160 |
1 |
1 |
125 |
f |
[NO2]A:156 |
x,y,z |
1_555 |
3 |
1 |
146 |
14.1 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.003 |
24 |
|
[SO4]A:158 |
1 |
1 |
184 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
8087 |
4.7 |
-0.6 |
0.532 |
0 |
0 |
0 |
0.000 |
|