| ## |
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 |
|
B |
79 |
28 |
11380 |
◊ |
A |
x,y,z |
1_555 |
86 |
25 |
11153 |
791.6 |
-0.7 |
0.498 |
10 |
2 |
0 |
0.000 |
2 |
|
A |
60 |
18 |
11153 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
58 |
16 |
11380 |
603.6 |
-1.8 |
0.489 |
8 |
8 |
0 |
0.000 |
3 |
|
B |
54 |
12 |
11380 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
46 |
12 |
11153 |
444.7 |
-0.4 |
0.486 |
6 |
3 |
0 |
0.000 |
4 |
|
A |
32 |
10 |
11153 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
36 |
8 |
11380 |
316.0 |
-3.7 |
0.215 |
1 |
0 |
0 |
0.000 |
5 |
|
A |
31 |
9 |
11153 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
39 |
11 |
11153 |
306.8 |
-1.2 |
0.488 |
2 |
0 |
0 |
0.000 |
6 |
|
B |
20 |
4 |
11380 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
20 |
5 |
11153 |
171.3 |
-0.3 |
0.497 |
3 |
3 |
0 |
0.000 |
7 |
|
[EDO]A:310 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
20 |
11 |
11153 |
114.3 |
4.2 |
0.528 |
2 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:309 |
4 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
11153 |
110.0 |
2.4 |
0.425 |
4 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:307 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
21 |
9 |
11153 |
105.2 |
3.0 |
0.607 |
2 |
0 |
0 |
0.000 |
10 |
|
[EDO]B:308 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
11380 |
98.4 |
3.7 |
0.490 |
6 |
0 |
0 |
0.000 |
11 |
|
[SO4]B:301 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
11380 |
95.8 |
-14.1 |
0.770 |
3 |
0 |
0 |
0.048 |
12 |
|
[SO4]A:302 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
11153 |
91.9 |
-13.2 |
0.754 |
3 |
0 |
0 |
0.093 |
13 |
|
[CL]B:306 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
11380 |
70.5 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.026 |
14 |
|
[CL]B:305 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
11380 |
66.0 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.033 |
15 |
|
B |
8 |
4 |
11380 |
◊ |
A |
-x+3/2,-y,z-1/2 |
2_654 |
3 |
2 |
11153 |
61.7 |
1.1 |
0.729 |
1 |
0 |
0 |
0.000 |
16 |
|
[EDO]B:311 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
11380 |
61.6 |
1.7 |
0.767 |
1 |
0 |
0 |
0.000 |
17 |
|
B |
6 |
2 |
11380 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
4 |
2 |
11380 |
58.0 |
1.4 |
0.831 |
1 |
2 |
0 |
0.000 |
18 |
|
[EDO]B:311 |
4 |
1 |
187 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
6 |
2 |
11153 |
48.8 |
1.7 |
0.884 |
0 |
0 |
0 |
0.000 |
19 |
|
B |
4 |
1 |
11380 |
x |
B |
-x+3/2,-y,z-1/2 |
2_654 |
3 |
2 |
11380 |
44.8 |
2.0 |
0.900 |
2 |
3 |
0 |
0.000 |
20 |
|
[CL]A:304 |
1 |
1 |
125 |
f |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
6 |
2 |
11153 |
43.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.032 |
21 |
|
[CL]A:304 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
11153 |
38.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.000 |
22 |
|
A |
7 |
2 |
11153 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
7 |
3 |
11153 |
32.2 |
0.5 |
0.700 |
0 |
0 |
0 |
0.000 |
23 |
|
[EDO]A:309 |
3 |
1 |
189 |
◊ |
[EDO]A:307 |
x,y,z |
1_555 |
4 |
1 |
184 |
27.5 |
1.4 |
1.000 |
0 |
0 |
0 |
0.000 |
24 |
|
[CL]A:304 |
1 |
1 |
125 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
4 |
2 |
11380 |
27.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
|
[SO4]B:301 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
11153 |
16.4 |
-1.8 |
0.797 |
0 |
0 |
0 |
0.000 |
26 |
|
[EDO]A:307 |
1 |
1 |
184 |
f |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
11153 |
4.9 |
-0.0 |
0.570 |
0 |
0 |
0 |
0.000 |
27 |
|
A |
1 |
1 |
11153 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
11380 |
2.7 |
0.1 |
0.742 |
0 |
0 |
0 |
0.000 |
|