| ## |
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 |
|
B |
224 |
56 |
10850 |
x |
B |
-y,x,z |
3_555 |
210 |
56 |
10850 |
2118.1 |
-26.6 |
0.155 |
26 |
9 |
0 |
0.668 |
2 |
|
A |
181 |
43 |
10499 |
x |
A |
-y,x,z |
3_555 |
197 |
51 |
10499 |
1774.3 |
-27.7 |
0.092 |
17 |
5 |
0 |
0.668 |
| Average: |
1946.2 |
-27.2 |
0.124 |
22 |
7 |
0 |
0.668 |
| 2 |
3 |
|
B |
50 |
16 |
10850 |
◊ |
A |
x,y,z |
1_555 |
52 |
17 |
10499 |
474.3 |
-3.8 |
0.577 |
15 |
0 |
0 |
0.068 |
| 3 |
4 |
|
B |
43 |
9 |
10850 |
◊ |
B |
-x,-y,z |
2_555 |
42 |
9 |
10850 |
361.9 |
-2.1 |
0.589 |
4 |
4 |
0 |
0.038 |
5 |
|
A |
1 |
1 |
10499 |
◊ |
A |
-x,-y,z |
2_555 |
1 |
1 |
10499 |
0.7 |
0.0 |
0.741 |
0 |
0 |
0 |
0.038 |
| Average: |
181.3 |
-1.1 |
0.665 |
2 |
2 |
0 |
0.038 |
| 4 |
6 |
|
B |
42 |
10 |
10850 |
◊ |
A |
x-1/2,y+1/2,z-1/2 |
5_454 |
40 |
13 |
10499 |
342.9 |
1.6 |
0.842 |
5 |
3 |
0 |
0.000 |
| 5 |
7 |
|
B |
37 |
13 |
10850 |
◊ |
A |
-y-1/2,x+1/2,z-1/2 |
7_454 |
32 |
9 |
10499 |
301.7 |
-3.3 |
0.477 |
0 |
0 |
0 |
0.000 |
| 6 |
8 |
|
B |
21 |
6 |
10850 |
◊ |
A |
-x,-y,z |
2_555 |
34 |
10 |
10499 |
264.1 |
-3.8 |
0.169 |
2 |
0 |
0 |
0.030 |
| 7 |
9 |
|
B |
14 |
5 |
10850 |
◊ |
A |
-y,x,z |
3_555 |
19 |
5 |
10499 |
113.9 |
-0.8 |
0.625 |
0 |
0 |
0 |
0.005 |
| 8 |
10 |
|
[SO4]A:1 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
10499 |
104.8 |
-17.2 |
0.671 |
3 |
0 |
0 |
0.281 |
| 9 |
11 |
|
[SO4]B:3 |
5 |
1 |
184 |
f |
B |
-y,x,z |
3_555 |
16 |
5 |
10850 |
69.0 |
-9.9 |
0.806 |
0 |
0 |
0 |
0.167 |
| 10 |
12 |
|
[SO4]B:2 |
5 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
10850 |
62.2 |
-8.1 |
0.930 |
4 |
0 |
0 |
0.063 |
| 11 |
13 |
|
[SO4]B:2 |
5 |
1 |
185 |
f |
A |
-y,x,z |
3_555 |
10 |
3 |
10499 |
59.6 |
-8.7 |
0.797 |
4 |
0 |
0 |
0.159 |
| 12 |
14 |
|
[SO4]B:3 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
10850 |
57.4 |
-6.6 |
0.947 |
2 |
0 |
0 |
0.127 |
| 13 |
15 |
|
B |
3 |
2 |
10850 |
◊ |
[SO4]B:2 |
-y,x,z |
3_555 |
4 |
1 |
185 |
29.4 |
-4.3 |
0.456 |
0 |
0 |
0 |
0.027 |
| 14 |
16 |
|
A |
2 |
2 |
10499 |
◊ |
[SO4]A:1 |
-y,x,z |
3_555 |
1 |
1 |
184 |
6.6 |
-0.9 |
0.621 |
0 |
0 |
0 |
0.014 |
| 15 |
17 |
|
A |
1 |
1 |
10499 |
◊ |
B |
-y,x,z |
3_555 |
1 |
1 |
10850 |
4.6 |
0.1 |
0.792 |
0 |
0 |
0 |
0.000 |
|