| ## |
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 |
|
C |
115 |
34 |
10590 |
◊ |
C |
x,-y+1,-z |
3_565 |
115 |
34 |
10590 |
1078.3 |
-0.3 |
0.761 |
14 |
2 |
0 |
0.000 |
2 |
|
A |
120 |
34 |
10560 |
◊ |
A |
-x,y,-z-1/2 |
4_554 |
119 |
33 |
10560 |
1025.5 |
6.1 |
0.927 |
20 |
0 |
0 |
0.000 |
| Average: |
1051.9 |
2.9 |
0.844 |
17 |
1 |
0 |
0.000 |
| 2 |
3 |
|
C |
57 |
18 |
10590 |
◊ |
A |
x-1/2,y+1/2,z |
5_455 |
65 |
21 |
10560 |
599.7 |
-9.4 |
0.070 |
1 |
0 |
0 |
0.000 |
4 |
|
C |
59 |
21 |
10590 |
◊ |
A |
x,y,z |
1_555 |
60 |
17 |
10560 |
587.2 |
-8.1 |
0.130 |
2 |
0 |
0 |
0.000 |
| Average: |
593.4 |
-8.7 |
0.100 |
2 |
0 |
0 |
0.000 |
| 3 |
5 |
|
[91F]A:2163 |
19 |
1 |
453 |
f |
A |
x,y,z |
1_555 |
55 |
18 |
10560 |
323.9 |
1.4 |
0.437 |
4 |
0 |
0 |
0.001 |
6 |
|
[91F]C:2163 |
19 |
1 |
456 |
f |
C |
x,y,z |
1_555 |
54 |
18 |
10590 |
322.0 |
1.4 |
0.443 |
4 |
0 |
0 |
0.001 |
| Average: |
323.0 |
1.4 |
0.440 |
4 |
0 |
0 |
0.001 |
| 4 |
7 |
|
[PEG]A:2167 |
7 |
1 |
263 |
◊ |
A |
x,y,z |
1_555 |
30 |
9 |
10560 |
147.6 |
3.0 |
0.361 |
2 |
0 |
0 |
0.000 |
| 5 |
8 |
|
[SO4]C:2164 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
21 |
10 |
10590 |
116.9 |
-17.9 |
0.702 |
6 |
0 |
0 |
0.053 |
| 6 |
9 |
|
[SO4]C:2165 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
19 |
6 |
10590 |
110.3 |
-16.1 |
0.770 |
4 |
0 |
0 |
0.046 |
| 7 |
10 |
|
[SO4]A:2165 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
10560 |
110.2 |
-16.0 |
0.762 |
4 |
0 |
0 |
0.048 |
| 8 |
11 |
|
[SO4]A:2164 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
10560 |
101.9 |
-15.8 |
0.793 |
5 |
0 |
0 |
0.049 |
| 9 |
12 |
|
A |
7 |
3 |
10560 |
◊ |
A |
x,-y,-z |
3_555 |
7 |
3 |
10560 |
93.5 |
2.0 |
0.902 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
C |
10 |
3 |
10590 |
◊ |
A |
-x,y,-z-1/2 |
4_554 |
6 |
2 |
10560 |
92.3 |
-0.9 |
0.287 |
1 |
1 |
0 |
0.000 |
| 11 |
14 |
|
C |
11 |
4 |
10590 |
◊ |
A |
x-1/2,-y+1/2,-z |
7_455 |
10 |
3 |
10560 |
92.0 |
-1.4 |
0.329 |
1 |
2 |
0 |
0.000 |
| 12 |
15 |
|
[GOL]A:2166 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
10560 |
84.4 |
-0.1 |
0.595 |
1 |
0 |
0 |
0.001 |
| 13 |
16 |
|
[GOL]A:2166 |
5 |
1 |
218 |
◊ |
A |
-x,y,-z-1/2 |
4_554 |
15 |
6 |
10560 |
69.7 |
0.6 |
0.692 |
1 |
0 |
0 |
0.000 |
| 14 |
17 |
|
C |
7 |
3 |
10590 |
◊ |
C |
-x,y,-z-1/2 |
4_554 |
7 |
3 |
10590 |
64.4 |
0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[GOL]A:2166 |
5 |
1 |
218 |
◊ |
[GOL]A:2166 |
-x,y,-z-1/2 |
4_554 |
5 |
1 |
218 |
60.2 |
-0.0 |
0.582 |
0 |
0 |
0 |
0.000 |
| 16 |
19 |
|
[SO4]C:2164 |
1 |
1 |
186 |
◊ |
A |
x-1/2,y+1/2,z |
5_455 |
2 |
2 |
10560 |
10.1 |
-1.1 |
0.797 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[SO4]A:2164 |
1 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
10590 |
10.0 |
-1.0 |
0.809 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[PEG]A:2167 |
1 |
1 |
263 |
f |
A |
-x,y,-z-1/2 |
4_554 |
2 |
1 |
10560 |
6.3 |
-0.1 |
0.296 |
0 |
0 |
0 |
0.000 |
|