## |
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 |
|
B |
49 |
13 |
12732 |
x |
B |
-x+2,y-1/2,-z |
2_745 |
54 |
15 |
12732 |
474.3 |
-3.1 |
0.365 |
8 |
1 |
0 |
0.000 |
2 |
|
A |
50 |
13 |
12765 |
x |
A |
-x+2,y-1/2,-z+1 |
2_746 |
48 |
13 |
12765 |
460.4 |
-4.6 |
0.224 |
7 |
2 |
0 |
0.000 |
Average: |
467.4 |
-3.8 |
0.294 |
8 |
2 |
0 |
0.000 |
2 |
3 |
|
A |
45 |
17 |
12765 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
48 |
17 |
12732 |
455.2 |
0.4 |
0.694 |
8 |
2 |
0 |
0.000 |
3 |
4 |
|
B |
40 |
14 |
12732 |
◊ |
A |
x,y,z |
1_555 |
44 |
16 |
12765 |
392.3 |
1.7 |
0.766 |
1 |
3 |
0 |
0.000 |
5 |
|
B |
48 |
15 |
12732 |
◊ |
A |
x,y,z-1 |
1_554 |
37 |
13 |
12765 |
381.5 |
-0.0 |
0.639 |
1 |
3 |
0 |
0.000 |
Average: |
386.9 |
0.8 |
0.703 |
1 |
3 |
0 |
0.000 |
4 |
6 |
|
B |
27 |
9 |
12732 |
x |
B |
x-1,y,z |
1_455 |
27 |
10 |
12732 |
249.0 |
2.0 |
0.827 |
4 |
2 |
0 |
0.000 |
7 |
|
A |
30 |
9 |
12765 |
x |
A |
x-1,y,z |
1_455 |
24 |
9 |
12765 |
233.3 |
1.2 |
0.767 |
1 |
2 |
0 |
0.000 |
Average: |
241.1 |
1.6 |
0.797 |
3 |
2 |
0 |
0.000 |
5 |
8 |
|
A |
18 |
3 |
12765 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
20 |
7 |
12765 |
175.9 |
1.6 |
0.829 |
5 |
0 |
0 |
0.000 |
9 |
|
B |
17 |
6 |
12732 |
x |
B |
-x+3,y-1/2,-z |
2_845 |
12 |
4 |
12732 |
121.4 |
1.3 |
0.803 |
2 |
0 |
0 |
0.000 |
Average: |
148.6 |
1.5 |
0.816 |
4 |
0 |
0 |
0.000 |
6 |
10 |
|
[SO4]A:501 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
12765 |
107.7 |
-19.4 |
0.255 |
7 |
0 |
0 |
0.035 |
7 |
11 |
|
[SO4]B:501 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
20 |
10 |
12732 |
107.7 |
-19.6 |
0.210 |
7 |
0 |
0 |
0.035 |
8 |
12 |
|
[ZN]B:500 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
9 |
7 |
12732 |
35.4 |
-25.9 |
0.000 |
0 |
0 |
0 |
0.040 |
13 |
|
[ZN]A:500 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
8 |
6 |
12765 |
35.0 |
-25.9 |
0.000 |
0 |
0 |
0 |
0.040 |
Average: |
35.2 |
-25.9 |
0.000 |
0 |
0 |
0 |
0.040 |
9 |
14 |
|
[SO4]A:501 |
4 |
1 |
185 |
f |
[ZN]A:500 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.4 |
-16.7 |
0.000 |
0 |
0 |
0 |
0.026 |
15 |
|
[SO4]B:501 |
4 |
1 |
185 |
f |
[ZN]B:500 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.1 |
-16.6 |
0.000 |
0 |
0 |
0 |
0.026 |
Average: |
30.2 |
-16.6 |
0.000 |
0 |
0 |
0 |
0.026 |
|