| ## |
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 |
53 |
16 |
5938 |
◊ |
C |
x-1/2,y+1/2,z |
3_455 |
54 |
16 |
6273 |
487.4 |
-8.0 |
0.143 |
4 |
0 |
0 |
0.030 |
2 |
|
D |
50 |
17 |
5908 |
◊ |
A |
x,y,z |
1_555 |
54 |
16 |
5757 |
448.8 |
-7.0 |
0.183 |
4 |
1 |
0 |
0.030 |
| Average: |
468.1 |
-7.5 |
0.163 |
4 |
1 |
0 |
0.030 |
| 2 |
3 |
|
C |
39 |
11 |
6273 |
◊ |
A |
x,y,z |
1_555 |
47 |
12 |
5757 |
424.1 |
-3.6 |
0.391 |
6 |
4 |
0 |
0.000 |
| 3 |
4 |
|
D |
35 |
10 |
5908 |
◊ |
A |
-x,y,-z |
2_555 |
41 |
9 |
5757 |
335.4 |
-1.9 |
0.530 |
5 |
3 |
0 |
0.000 |
| 4 |
5 |
|
C |
35 |
10 |
6273 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
36 |
9 |
5938 |
310.1 |
-0.5 |
0.651 |
6 |
3 |
0 |
0.008 |
| 5 |
6 |
|
A |
34 |
12 |
5757 |
◊ |
D |
-x+1/2,y-1/2,-z |
4_545 |
28 |
11 |
5908 |
308.3 |
-2.4 |
0.423 |
3 |
2 |
0 |
0.000 |
| 6 |
7 |
|
C |
33 |
7 |
6273 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
33 |
7 |
6273 |
258.3 |
-3.2 |
0.422 |
2 |
4 |
0 |
0.005 |
| 7 |
8 |
|
D |
33 |
8 |
5908 |
◊ |
D |
-x,y,-z |
2_555 |
33 |
8 |
5908 |
254.7 |
-2.8 |
0.426 |
2 |
4 |
0 |
0.000 |
| 8 |
9 |
|
B |
25 |
7 |
5938 |
x |
B |
x,y-1,z |
1_545 |
26 |
7 |
5938 |
231.2 |
-3.4 |
0.229 |
1 |
2 |
0 |
0.000 |
10 |
|
A |
24 |
7 |
5757 |
x |
A |
x,y-1,z |
1_545 |
23 |
6 |
5757 |
227.4 |
-2.0 |
0.381 |
3 |
4 |
0 |
0.000 |
| Average: |
229.3 |
-2.7 |
0.305 |
2 |
3 |
0 |
0.000 |
| 9 |
11 |
|
D |
19 |
5 |
5908 |
◊ |
B |
-x,y,-z |
2_555 |
21 |
7 |
5938 |
171.4 |
-1.1 |
0.504 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
B |
16 |
5 |
5938 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
19 |
5 |
6273 |
138.9 |
0.3 |
0.587 |
0 |
0 |
0 |
0.000 |
| 11 |
13 |
|
C |
15 |
6 |
6273 |
◊ |
B |
x,y,z |
1_555 |
18 |
7 |
5938 |
138.7 |
-0.2 |
0.607 |
1 |
0 |
0 |
0.000 |
| 12 |
14 |
|
[SO4]C:1119 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
15 |
5 |
6273 |
92.2 |
-13.5 |
0.874 |
4 |
0 |
0 |
0.100 |
| 13 |
15 |
|
[SO4]B:1116 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
5938 |
86.9 |
-13.1 |
0.657 |
2 |
0 |
0 |
0.100 |
| 14 |
16 |
|
[SO4]D:1116 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
14 |
5 |
5908 |
86.5 |
-12.4 |
0.803 |
3 |
0 |
0 |
0.067 |
| 15 |
17 |
|
A |
9 |
4 |
5757 |
◊ |
D |
x,y-1,z |
1_545 |
7 |
4 |
5908 |
68.4 |
-0.2 |
0.596 |
0 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[SO4]D:1117 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
5908 |
56.4 |
-6.4 |
0.891 |
1 |
0 |
0 |
0.033 |
| 17 |
19 |
|
D |
6 |
2 |
5908 |
x |
D |
x,y-1,z |
1_545 |
3 |
1 |
5908 |
42.1 |
1.1 |
0.841 |
1 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[SO4]B:1116 |
4 |
1 |
185 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
4 |
2 |
6273 |
40.7 |
-4.9 |
0.545 |
0 |
0 |
0 |
0.000 |
| 19 |
21 |
|
D |
2 |
1 |
5908 |
◊ |
C |
-x,y,-z |
2_555 |
3 |
1 |
6273 |
35.2 |
0.5 |
0.796 |
1 |
0 |
0 |
0.000 |
| 20 |
22 |
|
[SO4]B:1116 |
2 |
1 |
185 |
◊ |
C |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
6273 |
10.8 |
-1.1 |
0.907 |
0 |
0 |
0 |
0.003 |
| 21 |
23 |
|
C |
1 |
1 |
6273 |
x |
C |
x,y-1,z |
1_545 |
1 |
1 |
6273 |
4.6 |
0.1 |
0.577 |
0 |
0 |
0 |
0.000 |
| 22 |
24 |
|
B |
1 |
1 |
5938 |
◊ |
[SO4]C:1119 |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
184 |
0.9 |
-0.1 |
0.872 |
0 |
0 |
0 |
0.000 |
|