| ## |
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 |
113 |
36 |
15282 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
114 |
36 |
15282 |
1138.0 |
-12.0 |
0.095 |
14 |
10 |
0 |
0.107 |
2 |
|
A |
58 |
19 |
15282 |
x |
A |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
64 |
21 |
15282 |
514.4 |
-3.4 |
0.390 |
8 |
1 |
0 |
0.000 |
3 |
|
A |
45 |
15 |
15282 |
◊ |
A |
y,x,-z |
7_555 |
45 |
15 |
15282 |
418.8 |
2.2 |
0.815 |
2 |
0 |
0 |
0.000 |
4 |
|
[OGA]A:403 |
10 |
1 |
284 |
f |
A |
x,y,z |
1_555 |
35 |
13 |
15282 |
162.9 |
-0.0 |
0.395 |
7 |
0 |
0 |
0.034 |
5 |
|
[8P7]A:416 |
10 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
15282 |
141.7 |
4.5 |
0.187 |
1 |
0 |
0 |
0.000 |
6 |
|
A |
12 |
3 |
15282 |
x |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
15 |
5 |
15282 |
139.0 |
-0.5 |
0.506 |
2 |
0 |
0 |
0.000 |
7 |
|
[EDO]A:406 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
15282 |
126.5 |
3.6 |
0.622 |
1 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:404 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
15282 |
111.2 |
3.4 |
0.467 |
5 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:410 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
15282 |
107.5 |
3.6 |
0.483 |
2 |
0 |
0 |
0.000 |
10 |
|
[SO4]A:415 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
15282 |
99.8 |
-15.3 |
0.779 |
3 |
0 |
0 |
0.181 |
11 |
|
[SO4]A:412 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
15282 |
96.0 |
-13.2 |
0.866 |
4 |
0 |
0 |
0.163 |
12 |
|
[EDO]A:408 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
15282 |
95.5 |
2.8 |
0.452 |
4 |
0 |
0 |
0.000 |
13 |
|
[SO4]A:413 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
15282 |
86.7 |
-12.0 |
0.921 |
4 |
0 |
0 |
0.149 |
14 |
|
[EDO]A:405 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
15282 |
84.3 |
1.7 |
0.237 |
0 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:409 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
15282 |
82.8 |
2.0 |
0.371 |
1 |
0 |
0 |
0.000 |
16 |
|
[SO4]A:411 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
15282 |
81.1 |
-11.3 |
0.750 |
3 |
0 |
0 |
0.138 |
17 |
|
[SO4]A:414 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
15282 |
81.0 |
-11.9 |
0.761 |
5 |
0 |
0 |
0.153 |
18 |
|
A |
10 |
5 |
15282 |
f |
[EDO]A:409 |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
4 |
1 |
183 |
73.7 |
1.2 |
0.606 |
1 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:407 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
15282 |
73.2 |
3.3 |
0.678 |
3 |
0 |
0 |
0.000 |
20 |
|
A |
7 |
2 |
15282 |
x |
A |
-y+1/2,x-1/2,z-1/4 |
3_544 |
6 |
2 |
15282 |
65.7 |
-0.3 |
0.487 |
0 |
0 |
0 |
0.000 |
21 |
|
[NI]A:402 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
15282 |
42.3 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.074 |
22 |
|
[8P7]A:416 |
3 |
1 |
293 |
f |
[SO4]A:414 |
x,y,z |
1_555 |
4 |
1 |
184 |
38.8 |
-3.4 |
0.353 |
0 |
0 |
0 |
0.037 |
23 |
|
[SO4]A:414 |
4 |
1 |
184 |
cf |
[EDO]A:407 |
x,y,z |
1_555 |
4 |
1 |
184 |
36.5 |
-4.2 |
0.999 |
1 |
0 |
0 |
0.050 |
24 |
|
[OGA]A:403 |
4 |
1 |
284 |
f |
[NI]A:402 |
x,y,z |
1_555 |
1 |
1 |
115 |
34.6 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.048 |
25 |
|
[EDO]A:410 |
2 |
1 |
184 |
f |
[OGA]A:403 |
x,y,z |
1_555 |
7 |
1 |
284 |
28.8 |
1.1 |
0.678 |
0 |
0 |
0 |
0.000 |
26 |
|
[SO4]A:412 |
4 |
1 |
185 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
3 |
2 |
15282 |
25.4 |
-2.7 |
0.825 |
0 |
0 |
0 |
0.029 |
27 |
|
[8P7]A:416 |
2 |
1 |
293 |
f |
[EDO]A:407 |
x,y,z |
1_555 |
2 |
1 |
184 |
16.8 |
0.7 |
0.500 |
0 |
0 |
0 |
0.000 |
28 |
|
[EDO]A:410 |
2 |
1 |
184 |
f |
[NI]A:402 |
x,y,z |
1_555 |
1 |
1 |
115 |
13.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.011 |
29 |
|
[SO4]A:415 |
3 |
1 |
185 |
f |
[SO4]A:413 |
x,y,z |
1_555 |
1 |
1 |
184 |
10.4 |
-2.2 |
0.891 |
0 |
0 |
0 |
0.024 |
30 |
|
A |
1 |
1 |
15282 |
◊ |
[SO4]A:411 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
1 |
1 |
185 |
2.8 |
-0.2 |
0.907 |
0 |
0 |
0 |
0.000 |
|