## |
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 |
119 |
32 |
20546 |
x |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
105 |
27 |
20546 |
964.2 |
-5.9 |
0.195 |
14 |
2 |
0 |
0.000 |
2 |
|
A |
42 |
14 |
20546 |
x |
A |
-x-1/2,-y,z-1/2 |
2_454 |
41 |
11 |
20546 |
381.8 |
0.3 |
0.550 |
5 |
1 |
0 |
0.000 |
3 |
|
A |
32 |
11 |
20546 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
28 |
8 |
20546 |
252.2 |
-1.8 |
0.331 |
0 |
0 |
0 |
0.000 |
4 |
|
[7D8]A:607 |
11 |
1 |
311 |
cf |
A |
x,y,z |
1_555 |
29 |
14 |
20546 |
177.9 |
-1.8 |
0.366 |
12 |
0 |
0 |
0.010 |
5 |
|
[EDO]A:617 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
20546 |
113.5 |
3.0 |
0.345 |
2 |
0 |
0 |
0.000 |
6 |
|
[EDO]A:619 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
20546 |
105.5 |
4.1 |
0.508 |
2 |
0 |
0 |
0.000 |
7 |
|
[SO4]A:602 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
20546 |
103.9 |
-15.8 |
0.824 |
5 |
0 |
0 |
0.024 |
8 |
|
A |
22 |
8 |
20546 |
◊ |
[EDO]A:613 |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
1 |
182 |
92.6 |
2.4 |
0.396 |
0 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:610 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
20546 |
91.5 |
1.3 |
0.161 |
0 |
0 |
0 |
0.000 |
10 |
|
[SO4]A:603 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
20546 |
88.7 |
-13.2 |
0.641 |
2 |
0 |
0 |
0.019 |
11 |
|
[EDO]A:612 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
20546 |
88.1 |
2.4 |
0.397 |
1 |
0 |
0 |
0.000 |
12 |
|
[EDO]A:616 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
20546 |
87.7 |
2.4 |
0.429 |
2 |
0 |
0 |
0.000 |
13 |
|
[SO4]A:601 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
20546 |
84.0 |
-13.4 |
0.558 |
5 |
0 |
0 |
0.021 |
14 |
|
[EDO]A:608 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
20546 |
82.5 |
2.1 |
0.374 |
2 |
0 |
0 |
0.000 |
15 |
|
[SO4]A:605 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
13 |
3 |
20546 |
80.3 |
-11.2 |
0.806 |
2 |
0 |
0 |
0.016 |
16 |
|
[EDO]A:615 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
20546 |
78.5 |
1.8 |
0.745 |
3 |
0 |
0 |
0.000 |
17 |
|
[SO4]A:606 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
20546 |
77.4 |
-11.1 |
0.699 |
3 |
0 |
0 |
0.017 |
18 |
|
[EDO]A:609 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
27 |
9 |
20546 |
74.6 |
1.6 |
0.376 |
2 |
0 |
0 |
0.000 |
19 |
|
A |
14 |
7 |
20546 |
◊ |
[EDO]A:610 |
-x-1,y-1/2,-z-1/2 |
3_444 |
4 |
1 |
184 |
70.7 |
1.4 |
0.157 |
0 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:618 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
20546 |
70.6 |
1.7 |
0.777 |
0 |
0 |
0 |
0.000 |
21 |
|
[EDO]A:611 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
20546 |
66.6 |
0.7 |
0.535 |
3 |
0 |
0 |
0.000 |
22 |
|
[SO4]A:604 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
20546 |
66.1 |
-8.9 |
0.725 |
2 |
0 |
0 |
0.013 |
23 |
|
A |
13 |
7 |
20546 |
f |
[EDO]A:614 |
-x-1,y-1/2,-z-1/2 |
3_444 |
4 |
1 |
186 |
63.9 |
1.5 |
0.802 |
1 |
0 |
0 |
0.000 |
24 |
|
A |
14 |
5 |
20546 |
◊ |
[SO4]A:601 |
-x-1,y-1/2,-z-1/2 |
3_444 |
5 |
1 |
188 |
60.9 |
-8.3 |
0.703 |
0 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:614 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
20546 |
58.4 |
2.2 |
0.857 |
0 |
0 |
0 |
0.000 |
26 |
|
[EDO]A:613 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
20546 |
57.2 |
1.2 |
0.201 |
1 |
0 |
0 |
0.000 |
27 |
|
[SO4]A:603 |
3 |
1 |
186 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
6 |
3 |
20546 |
44.1 |
-4.4 |
0.943 |
2 |
0 |
0 |
0.000 |
28 |
|
[EDO]A:609 |
4 |
1 |
184 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
6 |
1 |
20546 |
38.7 |
0.8 |
0.774 |
1 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:616 |
4 |
1 |
182 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
5 |
1 |
20546 |
31.6 |
1.6 |
0.939 |
0 |
0 |
0 |
0.000 |
30 |
|
[EDO]A:616 |
2 |
1 |
182 |
f |
[EDO]A:612 |
x,y,z |
1_555 |
3 |
1 |
183 |
29.1 |
1.3 |
1.000 |
1 |
0 |
0 |
0.000 |
31 |
|
[7D8]A:607 |
4 |
1 |
311 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
3 |
1 |
20546 |
28.9 |
0.1 |
0.686 |
1 |
0 |
0 |
0.000 |
32 |
|
[EDO]A:608 |
2 |
1 |
187 |
f |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
5 |
1 |
20546 |
28.7 |
0.5 |
0.785 |
1 |
0 |
0 |
0.000 |
33 |
|
[EDO]A:609 |
4 |
1 |
184 |
◊ |
[EDO]A:608 |
x,y,z |
1_555 |
4 |
1 |
187 |
27.9 |
1.2 |
1.000 |
1 |
0 |
0 |
0.000 |
34 |
|
[EDO]A:612 |
3 |
1 |
183 |
f |
[EDO]A:609 |
x,y,z |
1_555 |
2 |
1 |
184 |
23.2 |
1.0 |
1.000 |
1 |
0 |
0 |
0.000 |
35 |
|
[EDO]A:608 |
2 |
1 |
187 |
◊ |
[7D8]A:607 |
x,y,z |
1_555 |
4 |
1 |
311 |
17.5 |
0.5 |
0.790 |
0 |
0 |
0 |
0.000 |
36 |
|
[SO4]A:604 |
2 |
1 |
188 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
2 |
1 |
20546 |
16.0 |
-1.8 |
0.845 |
0 |
0 |
0 |
0.000 |
37 |
|
[EDO]A:612 |
4 |
1 |
183 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
3 |
1 |
20546 |
14.5 |
0.7 |
0.908 |
0 |
0 |
0 |
0.000 |
38 |
|
[EDO]A:616 |
1 |
1 |
182 |
f |
[EDO]A:609 |
x,y,z |
1_555 |
1 |
1 |
184 |
11.8 |
0.8 |
0.500 |
0 |
0 |
0 |
0.000 |
39 |
|
[EDO]A:618 |
1 |
1 |
184 |
f |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
20546 |
7.9 |
0.4 |
0.906 |
0 |
0 |
0 |
0.000 |
|