| ## |
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 |
70 |
23 |
13737 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
68 |
23 |
13737 |
516.3 |
-0.4 |
0.620 |
8 |
0 |
0 |
0.021 |
2 |
|
A |
57 |
14 |
13737 |
x |
A |
-y+1/2,x-1/2,z+1/4 |
3_545 |
51 |
18 |
13737 |
471.4 |
-2.9 |
0.385 |
5 |
6 |
0 |
0.000 |
3 |
|
A |
51 |
14 |
13737 |
x |
A |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
47 |
15 |
13737 |
444.7 |
0.2 |
0.468 |
4 |
0 |
0 |
0.000 |
4 |
|
A |
32 |
9 |
13737 |
◊ |
A |
y,x,-z |
7_555 |
31 |
9 |
13737 |
292.0 |
-1.5 |
0.451 |
0 |
0 |
0 |
0.000 |
5 |
|
A |
20 |
8 |
13737 |
◊ |
A |
y,x,-z+1 |
7_556 |
20 |
8 |
13737 |
210.4 |
0.8 |
0.712 |
6 |
0 |
0 |
0.000 |
6 |
|
[SO4]A:316 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
13737 |
108.8 |
-16.9 |
0.721 |
4 |
0 |
0 |
0.195 |
7 |
|
[SO4]A:315 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
13737 |
95.0 |
-12.5 |
0.860 |
4 |
0 |
0 |
0.149 |
8 |
|
[SO4]A:318 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
13737 |
94.5 |
-12.4 |
0.727 |
3 |
0 |
0 |
0.144 |
9 |
|
[EDO]A:320 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
13737 |
91.2 |
2.9 |
0.479 |
3 |
0 |
0 |
0.000 |
10 |
|
[SO4]A:317 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
13737 |
91.0 |
-13.8 |
0.640 |
2 |
0 |
0 |
0.153 |
11 |
|
[EDO]A:323 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
13737 |
90.5 |
2.5 |
0.446 |
6 |
0 |
0 |
0.002 |
12 |
|
[EDO]A:321 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
13737 |
80.0 |
2.1 |
0.253 |
1 |
0 |
0 |
0.000 |
13 |
|
[EDO]A:324 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
13737 |
70.6 |
1.7 |
0.237 |
1 |
0 |
0 |
0.000 |
14 |
|
[EDO]A:322 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
13737 |
68.4 |
1.7 |
0.244 |
0 |
0 |
0 |
0.000 |
15 |
|
[SO4]A:319 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
13737 |
54.3 |
-7.1 |
0.688 |
1 |
0 |
0 |
0.079 |
16 |
|
[EDO]A:321 |
4 |
1 |
184 |
f |
A |
y,x,-z+1 |
7_556 |
4 |
2 |
13737 |
46.2 |
0.8 |
0.519 |
0 |
0 |
0 |
0.000 |
17 |
|
[SO4]A:317 |
3 |
1 |
184 |
◊ |
A |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
5 |
1 |
13737 |
41.3 |
-5.1 |
0.727 |
0 |
0 |
0 |
0.000 |
18 |
|
[SO4]A:319 |
5 |
1 |
185 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
5 |
3 |
13737 |
37.3 |
-4.5 |
0.513 |
0 |
0 |
0 |
0.047 |
19 |
|
[EDO]A:323 |
3 |
1 |
184 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
6 |
3 |
13737 |
34.4 |
0.8 |
0.618 |
0 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:324 |
3 |
1 |
186 |
f |
[SO4]A:319 |
x,y,z |
1_555 |
4 |
1 |
185 |
34.2 |
-3.0 |
0.999 |
1 |
0 |
0 |
0.036 |
21 |
|
[EDO]A:320 |
2 |
1 |
185 |
f |
[SO4]A:315 |
x,y,z |
1_555 |
3 |
1 |
185 |
33.9 |
-3.1 |
0.996 |
1 |
0 |
0 |
0.037 |
22 |
|
[EDO]A:324 |
4 |
1 |
186 |
◊ |
[SO4]A:319 |
-y+1,-x+1,-z+1/2 |
8_665 |
4 |
1 |
185 |
32.0 |
-2.6 |
0.999 |
0 |
0 |
0 |
0.027 |
23 |
|
[SO4]A:318 |
4 |
1 |
185 |
f |
[SO4]A:316 |
x,y,z |
1_555 |
4 |
1 |
185 |
30.0 |
-6.7 |
0.998 |
0 |
0 |
0 |
0.070 |
24 |
|
[EDO]A:320 |
3 |
1 |
185 |
f |
[SO4]A:318 |
x,y,z |
1_555 |
3 |
1 |
185 |
28.0 |
-2.4 |
0.996 |
1 |
0 |
0 |
0.029 |
25 |
|
[EDO]A:324 |
2 |
1 |
186 |
◊ |
[EDO]A:324 |
-y+1,-x+1,-z+1/2 |
8_665 |
2 |
1 |
186 |
24.4 |
1.4 |
1.000 |
0 |
0 |
0 |
0.000 |
26 |
|
[SO4]A:319 |
4 |
1 |
185 |
◊ |
[SO4]A:319 |
-y+1,-x+1,-z+1/2 |
8_665 |
4 |
1 |
185 |
19.7 |
-4.3 |
0.998 |
0 |
0 |
0 |
0.022 |
27 |
|
[SO4]A:318 |
3 |
1 |
185 |
f |
[SO4]A:315 |
x,y,z |
1_555 |
2 |
1 |
185 |
18.1 |
-4.3 |
0.976 |
0 |
0 |
0 |
0.045 |
28 |
|
[EDO]A:323 |
2 |
1 |
184 |
◊ |
[EDO]A:323 |
-y+1,-x+1,-z+1/2 |
8_665 |
2 |
1 |
184 |
17.8 |
1.2 |
1.000 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
5 |
1 |
13737 |
x |
A |
-y+1/2,x+1/2,z+1/4 |
3_555 |
2 |
1 |
13737 |
17.2 |
0.2 |
0.680 |
0 |
0 |
0 |
0.000 |
30 |
|
[EDO]A:322 |
2 |
1 |
187 |
f |
A |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
5 |
2 |
13737 |
6.6 |
-0.2 |
0.655 |
0 |
0 |
0 |
0.002 |
31 |
|
[EDO]A:324 |
2 |
1 |
186 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
2 |
1 |
13737 |
3.7 |
0.0 |
0.679 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
2 |
1 |
13737 |
x |
A |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
2 |
1 |
13737 |
2.8 |
-0.0 |
0.566 |
0 |
0 |
0 |
0.000 |
|