## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
A |
70 |
21 |
9753 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
70 |
21 |
9753 |
593.2 |
-4.3 |
0.359 |
5 |
0 |
0 |
0.001 |
2 |
2 |
|
A |
36 |
6 |
9753 |
x |
A |
x-1/2,-y+1/2,-z |
8_455 |
43 |
16 |
9753 |
371.3 |
1.2 |
0.681 |
5 |
5 |
0 |
0.000 |
3 |
3 |
|
A |
41 |
11 |
9753 |
◊ |
A |
x,-y+1,-z |
4_565 |
41 |
11 |
9753 |
321.5 |
-4.9 |
0.199 |
2 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
26 |
10 |
9753 |
x |
A |
x-1,y,z |
1_455 |
26 |
8 |
9753 |
201.1 |
-3.2 |
0.232 |
0 |
0 |
0 |
0.000 |
5 |
5 |
|
[SO4]A:1 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
24 |
12 |
9753 |
102.6 |
-16.0 |
0.580 |
3 |
0 |
0 |
0.007 |
6 |
6 |
|
[CO3]A:5 |
4 |
1 |
165 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
9753 |
94.7 |
0.6 |
0.531 |
1 |
0 |
0 |
0.000 |
7 |
7 |
|
[SO4]A:4 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
9753 |
93.8 |
-13.2 |
0.726 |
2 |
0 |
0 |
0.006 |
8 |
8 |
|
[SO4]A:3 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
9753 |
83.0 |
-12.7 |
0.678 |
2 |
0 |
0 |
0.006 |
9 |
9 |
|
[SO4]A:2 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
9753 |
77.5 |
-9.9 |
0.922 |
2 |
0 |
0 |
0.004 |
10 |
10 |
|
[CL]A:7 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
9753 |
65.5 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.005 |
11 |
11 |
|
[CO3]A:6 |
4 |
1 |
163 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
9753 |
62.4 |
0.5 |
0.608 |
2 |
0 |
0 |
0.000 |
12 |
12 |
|
[CL]A:8 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
9753 |
50.7 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.002 |
13 |
13 |
|
[CL]A:9 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
9753 |
50.3 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.003 |
14 |
14 |
|
[CL]A:11 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
9753 |
48.9 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.005 |
15 |
|
[CL]A:12 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
9753 |
47.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.005 |
Average: |
48.4 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.005 |
15 |
16 |
|
A |
5 |
3 |
9753 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
5 |
3 |
9753 |
47.6 |
2.2 |
0.916 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[CL]A:10 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
9753 |
38.2 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.002 |
17 |
18 |
|
[ZN]A:309 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
9753 |
36.9 |
-24.7 |
0.000 |
0 |
0 |
0 |
0.010 |
18 |
19 |
|
[ZN]A:308 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
9753 |
36.1 |
-25.0 |
0.000 |
0 |
0 |
0 |
0.010 |
19 |
20 |
|
[ZN]A:310 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
9753 |
29.0 |
-14.1 |
0.000 |
0 |
0 |
0 |
0.006 |
20 |
21 |
|
[ZN]A:309 |
1 |
1 |
98 |
f |
[SO4]A:1 |
x,y,z |
1_555 |
4 |
1 |
184 |
27.4 |
-14.2 |
0.000 |
0 |
0 |
0 |
0.006 |
21 |
22 |
|
[ZN]A:308 |
1 |
1 |
98 |
f |
[SO4]A:1 |
x,y,z |
1_555 |
4 |
1 |
184 |
26.3 |
-13.2 |
0.000 |
0 |
0 |
0 |
0.006 |
22 |
23 |
|
[ZN]A:310 |
1 |
1 |
98 |
f |
[CL]A:12 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.1 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.005 |
23 |
24 |
|
[CL]A:11 |
1 |
1 |
125 |
f |
[CL]A:10 |
x,y,z |
1_555 |
1 |
1 |
125 |
21.8 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.002 |
24 |
25 |
|
[SO4]A:2 |
3 |
1 |
183 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
4 |
2 |
9753 |
21.8 |
-2.5 |
0.717 |
0 |
0 |
0 |
0.001 |
25 |
26 |
|
[ZN]A:310 |
1 |
1 |
98 |
f |
[CL]A:11 |
x,y,z |
1_555 |
1 |
1 |
125 |
21.8 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.005 |
26 |
27 |
|
[ZN]A:310 |
1 |
1 |
98 |
f |
[CL]A:10 |
x,y,z |
1_555 |
1 |
1 |
125 |
20.0 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.004 |
27 |
28 |
|
[CL]A:12 |
1 |
1 |
125 |
f |
[CL]A:11 |
x,y,z |
1_555 |
1 |
1 |
125 |
19.7 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.002 |
28 |
29 |
|
[CL]A:12 |
1 |
1 |
125 |
f |
[CL]A:10 |
x,y,z |
1_555 |
1 |
1 |
125 |
15.0 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.001 |
29 |
30 |
|
[ZN]A:309 |
1 |
1 |
98 |
f |
[ZN]A:308 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.2 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.003 |
30 |
31 |
|
A |
2 |
1 |
9753 |
◊ |
[CL]A:9 |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
125 |
5.9 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
31 |
32 |
|
A |
1 |
1 |
9753 |
◊ |
[CL]A:11 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
3.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
33 |
|
[SO4]A:4 |
1 |
1 |
185 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
9753 |
0.7 |
-0.1 |
0.835 |
0 |
0 |
0 |
0.000 |
|