| ## |
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 |
311 |
85 |
16338 |
◊ |
A |
-y,x-y,z+1/3 |
2_555 |
301 |
81 |
16376 |
3019.1 |
-6.8 |
0.777 |
54 |
22 |
0 |
0.509 |
| 2 |
2 |
|
B |
35 |
13 |
16338 |
◊ |
A |
x-y,-y+1,-z+5/3 |
5_566 |
31 |
11 |
16376 |
289.2 |
0.2 |
0.709 |
2 |
3 |
0 |
0.000 |
3 |
|
A |
30 |
13 |
16376 |
◊ |
B |
-x+1,-x+y,-z+4/3 |
6_656 |
24 |
10 |
16338 |
252.3 |
-0.3 |
0.643 |
3 |
2 |
0 |
0.000 |
| Average: |
270.8 |
-0.0 |
0.676 |
3 |
3 |
0 |
0.000 |
| 3 |
4 |
|
B |
30 |
11 |
16338 |
x |
B |
x-y,-y+1,-z+5/3 |
5_566 |
28 |
10 |
16338 |
265.0 |
-1.1 |
0.524 |
1 |
1 |
0 |
0.000 |
5 |
|
A |
30 |
11 |
16376 |
x |
A |
-x+1,-x+y,-z+4/3 |
6_656 |
27 |
9 |
16376 |
262.4 |
-1.6 |
0.437 |
0 |
2 |
0 |
0.000 |
| Average: |
263.7 |
-1.4 |
0.480 |
1 |
2 |
0 |
0.000 |
| 4 |
6 |
|
B |
33 |
11 |
16338 |
◊ |
B |
-x,-x+y,-z+4/3 |
6_556 |
33 |
11 |
16338 |
236.5 |
-0.4 |
0.653 |
4 |
0 |
0 |
0.000 |
7 |
|
A |
23 |
9 |
16376 |
◊ |
A |
x-y,-y,-z+5/3 |
5_556 |
23 |
9 |
16376 |
190.5 |
1.3 |
0.802 |
3 |
0 |
0 |
0.000 |
| Average: |
213.5 |
0.4 |
0.728 |
4 |
0 |
0 |
0.000 |
| 5 |
8 |
|
B |
26 |
8 |
16338 |
◊ |
A |
x-1,y,z |
1_455 |
23 |
7 |
16376 |
200.1 |
-1.4 |
0.491 |
1 |
2 |
0 |
0.000 |
9 |
|
A |
18 |
8 |
16376 |
◊ |
B |
x,y-1,z |
1_545 |
13 |
6 |
16338 |
106.4 |
-0.9 |
0.509 |
1 |
1 |
0 |
0.000 |
| Average: |
153.3 |
-1.2 |
0.500 |
1 |
2 |
0 |
0.000 |
| 6 |
10 |
|
B |
12 |
5 |
16338 |
◊ |
B |
x-y,-y,-z+5/3 |
5_556 |
12 |
5 |
16338 |
126.0 |
0.4 |
0.708 |
0 |
0 |
0 |
0.000 |
11 |
|
A |
14 |
5 |
16376 |
◊ |
A |
-x,-x+y,-z+4/3 |
6_556 |
13 |
4 |
16376 |
102.3 |
0.2 |
0.683 |
0 |
0 |
0 |
0.000 |
| Average: |
114.2 |
0.3 |
0.695 |
0 |
0 |
0 |
0.000 |
| 7 |
12 |
|
[SO4]A:390 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
16376 |
68.1 |
-10.0 |
0.789 |
4 |
0 |
0 |
0.175 |
| 8 |
13 |
|
[SO4]B:391 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
16338 |
66.5 |
-9.8 |
0.763 |
4 |
0 |
0 |
0.173 |
| 9 |
14 |
|
B |
8 |
3 |
16338 |
x |
B |
-y,x-y,z+1/3 |
2_555 |
4 |
1 |
16338 |
59.1 |
0.6 |
0.783 |
0 |
1 |
0 |
0.000 |
15 |
|
A |
3 |
1 |
16376 |
x |
A |
-y,x-y,z+1/3 |
2_555 |
8 |
3 |
16376 |
55.0 |
-0.1 |
0.508 |
1 |
2 |
0 |
0.000 |
| Average: |
57.1 |
0.2 |
0.645 |
1 |
2 |
0 |
0.000 |
| 10 |
16 |
|
[SO4]B:391 |
4 |
1 |
188 |
◊ |
A |
-y,x-y,z+1/3 |
2_555 |
2 |
1 |
16376 |
43.2 |
-3.9 |
0.984 |
2 |
0 |
0 |
0.072 |
| 11 |
17 |
|
B |
2 |
1 |
16338 |
◊ |
[SO4]A:390 |
-y,x-y,z+1/3 |
2_555 |
4 |
1 |
188 |
43.1 |
-3.9 |
0.983 |
2 |
0 |
0 |
0.071 |
| 12 |
18 |
|
B |
4 |
3 |
16338 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
16376 |
21.8 |
0.0 |
0.657 |
0 |
0 |
0 |
0.000 |
|