| ## |
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 |
128 |
36 |
28153 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
117 |
31 |
28153 |
1120.5 |
-5.2 |
0.254 |
10 |
1 |
0 |
0.000 |
2 |
|
A |
99 |
31 |
28153 |
x |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
102 |
30 |
28153 |
929.2 |
-6.1 |
0.166 |
8 |
0 |
0 |
0.000 |
3 |
|
[PVC]A:1891 |
27 |
1 |
663 |
f |
A |
x,y,z |
1_555 |
60 |
21 |
28153 |
414.9 |
-5.6 |
0.669 |
6 |
0 |
0 |
0.012 |
4 |
|
[XYL]A:1893 |
10 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
29 |
11 |
28153 |
184.9 |
2.0 |
0.524 |
7 |
0 |
0 |
0.002 |
5 |
|
A |
24 |
7 |
28153 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
19 |
7 |
28153 |
178.4 |
-1.9 |
0.225 |
1 |
0 |
0 |
0.000 |
6 |
|
A |
17 |
10 |
28153 |
◊ |
[XYL]A:1892 |
x-1/2,-y-1/2,-z+1 |
4_446 |
10 |
1 |
289 |
154.3 |
2.0 |
0.579 |
6 |
0 |
0 |
0.000 |
7 |
|
[SO4]A:1895 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
28153 |
93.0 |
-14.1 |
0.610 |
1 |
0 |
0 |
0.022 |
8 |
|
[SO4]A:1899 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
28153 |
85.9 |
-8.4 |
0.965 |
4 |
0 |
0 |
0.015 |
9 |
|
[XYL]A:1892 |
5 |
1 |
289 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
28153 |
82.0 |
0.7 |
0.389 |
1 |
0 |
0 |
0.000 |
10 |
|
[SO4]A:1897 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
28153 |
80.7 |
-12.2 |
0.578 |
3 |
0 |
0 |
0.020 |
11 |
|
A |
7 |
3 |
28153 |
◊ |
[PVC]A:1891 |
x-1/2,-y-1/2,-z+1 |
4_446 |
7 |
1 |
663 |
76.9 |
-0.7 |
0.751 |
0 |
0 |
0 |
0.000 |
12 |
|
[SO4]A:1896 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
28153 |
67.8 |
-9.9 |
0.614 |
3 |
0 |
0 |
0.017 |
13 |
|
[SO4]A:1898 |
5 |
1 |
184 |
f |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
8 |
2 |
28153 |
58.1 |
-7.0 |
0.845 |
1 |
0 |
0 |
0.011 |
14 |
|
[SO4]A:1899 |
5 |
1 |
185 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
10 |
4 |
28153 |
56.4 |
-6.5 |
0.819 |
2 |
0 |
0 |
0.000 |
15 |
|
[SO4]A:1898 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
28153 |
41.2 |
-4.0 |
0.921 |
1 |
0 |
0 |
0.000 |
16 |
|
A |
2 |
2 |
28153 |
◊ |
[XYL]A:1893 |
x-1/2,-y-1/2,-z+1 |
4_446 |
4 |
1 |
295 |
28.1 |
-0.2 |
0.480 |
0 |
0 |
0 |
0.000 |
17 |
|
[XYL]A:1892 |
1 |
1 |
289 |
f |
[PVC]A:1891 |
x,y,z |
1_555 |
2 |
1 |
663 |
20.5 |
-1.5 |
0.253 |
0 |
0 |
0 |
0.002 |
18 |
|
A |
2 |
1 |
28153 |
x |
A |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
28153 |
8.8 |
0.5 |
0.851 |
0 |
0 |
0 |
0.000 |
|