| ## |
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 |
|
D |
86 |
23 |
6430 |
◊ |
B |
x,y,z |
1_555 |
87 |
22 |
7684 |
778.1 |
-6.5 |
0.282 |
9 |
0 |
0 |
0.269 |
2 |
|
C |
87 |
23 |
6546 |
◊ |
A |
x,y,z |
1_555 |
89 |
22 |
7691 |
775.5 |
-5.8 |
0.341 |
9 |
0 |
0 |
0.269 |
| Average: |
776.8 |
-6.1 |
0.312 |
9 |
0 |
0 |
0.269 |
| 2 |
3 |
|
B |
57 |
18 |
7684 |
◊ |
A |
x,y,z |
1_555 |
56 |
18 |
7691 |
605.9 |
0.2 |
0.668 |
11 |
0 |
0 |
0.114 |
| 3 |
4 |
|
D |
50 |
18 |
6430 |
◊ |
C |
x,y,z-1 |
1_554 |
51 |
19 |
6546 |
430.9 |
-1.4 |
0.585 |
1 |
0 |
0 |
0.000 |
| 4 |
5 |
|
B |
33 |
11 |
7684 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
35 |
13 |
7691 |
314.7 |
0.5 |
0.666 |
1 |
3 |
0 |
0.000 |
| 5 |
6 |
|
A |
26 |
7 |
7691 |
◊ |
C |
x-1,y,z |
1_455 |
30 |
10 |
6546 |
245.8 |
1.3 |
0.762 |
2 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
22 |
9 |
7684 |
◊ |
D |
x-1,y,z |
1_455 |
28 |
13 |
6430 |
237.7 |
0.4 |
0.682 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
25 |
10 |
7684 |
◊ |
D |
-x,y-1/2,-z-1 |
2_544 |
25 |
8 |
6430 |
230.2 |
-0.6 |
0.566 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
C |
28 |
8 |
6546 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
26 |
9 |
6430 |
212.5 |
0.5 |
0.715 |
0 |
1 |
0 |
0.000 |
| 9 |
10 |
|
B |
21 |
6 |
7684 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
25 |
8 |
6430 |
196.6 |
0.8 |
0.721 |
0 |
2 |
0 |
0.000 |
| 10 |
11 |
|
C |
26 |
8 |
6546 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
23 |
6 |
7691 |
196.6 |
0.9 |
0.727 |
1 |
1 |
0 |
0.000 |
| 11 |
12 |
|
B |
16 |
7 |
7684 |
◊ |
C |
x,y,z-1 |
1_554 |
20 |
7 |
6546 |
163.8 |
-0.9 |
0.394 |
0 |
0 |
0 |
0.000 |
13 |
|
D |
17 |
6 |
6430 |
◊ |
A |
x,y,z-1 |
1_554 |
14 |
6 |
7691 |
150.8 |
-1.8 |
0.310 |
0 |
0 |
0 |
0.000 |
| Average: |
157.3 |
-1.3 |
0.352 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
C |
14 |
4 |
6546 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
7684 |
151.4 |
-0.7 |
0.418 |
0 |
1 |
0 |
0.018 |
15 |
|
D |
13 |
4 |
6430 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
7691 |
135.1 |
-0.4 |
0.385 |
0 |
1 |
0 |
0.018 |
| Average: |
143.3 |
-0.5 |
0.401 |
0 |
1 |
0 |
0.018 |
| 13 |
16 |
|
[SO4]A:201 |
5 |
1 |
186 |
f |
C |
x-1,y,z |
1_455 |
12 |
7 |
6546 |
81.4 |
-11.7 |
0.745 |
0 |
0 |
0 |
0.156 |
| 14 |
17 |
|
[SO4]B:202 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
7684 |
78.9 |
-11.3 |
0.782 |
3 |
0 |
0 |
0.304 |
| 15 |
18 |
|
C |
9 |
5 |
6546 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
12 |
6 |
7691 |
77.7 |
-0.1 |
0.602 |
0 |
0 |
0 |
0.000 |
| 16 |
19 |
|
[SO4]B:201 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
7684 |
62.7 |
-8.2 |
0.721 |
0 |
0 |
0 |
0.197 |
| 17 |
20 |
|
[SO4]B:201 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
7691 |
61.0 |
-8.0 |
0.723 |
0 |
0 |
0 |
0.193 |
| 18 |
21 |
|
[SO4]B:202 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
9 |
6 |
7691 |
59.6 |
-8.0 |
0.785 |
0 |
0 |
0 |
0.193 |
| 19 |
22 |
|
A |
5 |
2 |
7691 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
7 |
3 |
6430 |
58.0 |
0.1 |
0.616 |
0 |
0 |
0 |
0.000 |
| 20 |
23 |
|
C |
4 |
1 |
6546 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
7 |
4 |
6430 |
37.9 |
0.3 |
0.692 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
B |
3 |
1 |
7684 |
◊ |
C |
x-1,y,z-1 |
1_454 |
2 |
1 |
6546 |
8.7 |
0.3 |
0.754 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
C |
2 |
1 |
6546 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
1 |
1 |
7684 |
7.4 |
-0.1 |
0.375 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[SO4]A:201 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
7691 |
4.5 |
-0.6 |
0.615 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
[SO4]A:201 |
1 |
1 |
186 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
7691 |
3.4 |
-0.4 |
0.816 |
0 |
0 |
0 |
0.005 |
| 25 |
28 |
|
C |
1 |
1 |
6546 |
x |
C |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
6546 |
2.9 |
-0.1 |
0.395 |
0 |
0 |
0 |
0.000 |
|