| ## |
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 |
44 |
14 |
11334 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
53 |
12 |
11264 |
459.9 |
-0.4 |
0.552 |
4 |
2 |
0 |
0.000 |
2 |
|
B |
50 |
12 |
11334 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
45 |
14 |
11264 |
442.8 |
-0.9 |
0.514 |
2 |
2 |
0 |
0.000 |
3 |
|
D |
46 |
14 |
11235 |
◊ |
C |
-x+1,y-1/2,-z-1 |
2_644 |
45 |
10 |
11291 |
439.2 |
-0.2 |
0.526 |
3 |
2 |
0 |
0.000 |
4 |
|
D |
48 |
11 |
11235 |
◊ |
C |
-x+2,y-1/2,-z-1 |
2_744 |
43 |
14 |
11291 |
437.1 |
-0.8 |
0.502 |
4 |
2 |
0 |
0.000 |
| Average: |
444.8 |
-0.6 |
0.524 |
3 |
2 |
0 |
0.000 |
| 2 |
5 |
|
C |
45 |
13 |
11291 |
◊ |
B |
x,y,z-1 |
1_554 |
37 |
12 |
11334 |
407.1 |
-2.5 |
0.293 |
1 |
0 |
0 |
0.000 |
| 3 |
6 |
|
B |
38 |
13 |
11334 |
◊ |
A |
x,y,z |
1_555 |
39 |
13 |
11264 |
374.9 |
-7.1 |
0.056 |
5 |
0 |
0 |
0.023 |
7 |
|
D |
38 |
13 |
11235 |
◊ |
C |
x,y,z |
1_555 |
38 |
13 |
11291 |
362.5 |
-7.0 |
0.055 |
6 |
0 |
0 |
0.023 |
| Average: |
368.7 |
-7.0 |
0.055 |
6 |
0 |
0 |
0.023 |
| 4 |
8 |
|
C |
32 |
10 |
11291 |
◊ |
B |
x,y,z |
1_555 |
32 |
11 |
11334 |
285.6 |
0.6 |
0.640 |
2 |
0 |
0 |
0.000 |
| 5 |
9 |
|
C |
27 |
8 |
11291 |
x |
C |
-x+1,y-1/2,-z-1 |
2_644 |
25 |
10 |
11291 |
228.6 |
-1.7 |
0.372 |
1 |
0 |
0 |
0.000 |
10 |
|
B |
24 |
9 |
11334 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
23 |
8 |
11334 |
227.4 |
-1.2 |
0.425 |
1 |
0 |
0 |
0.000 |
11 |
|
A |
25 |
8 |
11264 |
x |
A |
-x,y-1/2,-z |
2_545 |
23 |
8 |
11264 |
222.5 |
-1.8 |
0.363 |
1 |
0 |
0 |
0.000 |
12 |
|
D |
24 |
8 |
11235 |
x |
D |
-x+2,y-1/2,-z-1 |
2_744 |
23 |
7 |
11235 |
213.4 |
-2.1 |
0.316 |
0 |
0 |
0 |
0.000 |
| Average: |
223.0 |
-1.7 |
0.369 |
1 |
0 |
0 |
0.000 |
| 6 |
13 |
|
D |
25 |
8 |
11235 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
28 |
6 |
11264 |
200.3 |
0.6 |
0.638 |
2 |
0 |
0 |
0.000 |
| 7 |
14 |
|
A |
20 |
4 |
11264 |
◊ |
D |
x-1,y,z |
1_455 |
25 |
8 |
11235 |
189.7 |
0.1 |
0.587 |
1 |
0 |
0 |
0.000 |
| 8 |
15 |
|
D |
19 |
9 |
11235 |
◊ |
A |
-x+1,y-1/2,-z-1 |
2_644 |
20 |
8 |
11264 |
167.0 |
2.9 |
0.807 |
1 |
1 |
0 |
0.000 |
| 9 |
16 |
|
[GOL]D:602 |
6 |
1 |
219 |
◊ |
C |
-x+1,y-1/2,-z-1 |
2_644 |
26 |
9 |
11291 |
132.8 |
-0.2 |
0.536 |
6 |
0 |
0 |
0.158 |
| 10 |
17 |
|
[SO4]C:501 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
11291 |
104.0 |
-12.7 |
0.890 |
5 |
0 |
0 |
0.811 |
| 11 |
18 |
|
[SO4]B:502 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
11334 |
102.8 |
-12.6 |
0.891 |
3 |
0 |
0 |
0.052 |
| 12 |
19 |
|
[SO4]A:503 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
11264 |
100.3 |
-11.3 |
0.930 |
5 |
0 |
0 |
0.100 |
| 13 |
20 |
|
[SO4]D:504 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
11235 |
99.7 |
-12.5 |
0.853 |
4 |
0 |
0 |
0.100 |
| 14 |
21 |
|
B |
11 |
4 |
11334 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
11 |
4 |
11291 |
94.8 |
0.9 |
0.715 |
2 |
0 |
0 |
0.000 |
| 15 |
22 |
|
[SO4]B:505 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
11334 |
87.3 |
-8.9 |
0.944 |
3 |
0 |
0 |
0.038 |
| 16 |
23 |
|
A |
12 |
6 |
11264 |
◊ |
D |
x-1,y,z+1 |
1_456 |
8 |
3 |
11235 |
82.3 |
1.1 |
0.720 |
1 |
0 |
0 |
0.000 |
| 17 |
24 |
|
[GOL]C:601 |
5 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
6 |
1 |
11291 |
64.3 |
0.4 |
0.642 |
1 |
0 |
0 |
0.002 |
| 18 |
25 |
|
D |
9 |
4 |
11235 |
◊ |
[GOL]C:601 |
-x+2,y-1/2,-z-1 |
2_744 |
3 |
1 |
220 |
57.2 |
1.0 |
0.644 |
2 |
0 |
0 |
0.000 |
| 19 |
26 |
|
B |
9 |
6 |
11334 |
◊ |
C |
-x+1,y-1/2,-z-1 |
2_644 |
11 |
6 |
11291 |
55.9 |
0.6 |
0.676 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
B |
3 |
1 |
11334 |
◊ |
D |
x-1,y,z |
1_455 |
6 |
1 |
11235 |
41.6 |
0.2 |
0.579 |
0 |
0 |
0 |
0.000 |
| 21 |
28 |
|
C |
3 |
1 |
11291 |
◊ |
D |
x-1,y,z |
1_455 |
2 |
1 |
11235 |
26.8 |
1.3 |
0.914 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
1 |
1 |
11264 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
11334 |
4.6 |
0.1 |
0.547 |
0 |
0 |
0 |
0.000 |
| Average: |
15.7 |
0.7 |
0.730 |
0 |
0 |
0 |
0.000 |
| 22 |
30 |
|
[SO4]B:505 |
3 |
1 |
185 |
f |
[SO4]B:502 |
x,y,z |
1_555 |
3 |
1 |
184 |
11.6 |
-2.7 |
0.992 |
0 |
0 |
0 |
0.010 |
| 23 |
31 |
|
[GOL]D:602 |
1 |
1 |
219 |
◊ |
[SO4]C:501 |
-x+1,y-1/2,-z-1 |
2_644 |
1 |
1 |
185 |
4.9 |
-0.5 |
0.632 |
0 |
0 |
0 |
0.029 |
| 24 |
32 |
|
[SO4]D:504 |
1 |
1 |
185 |
◊ |
[GOL]C:601 |
-x+2,y-1/2,-z-1 |
2_744 |
2 |
1 |
220 |
3.0 |
-0.3 |
0.764 |
0 |
0 |
0 |
0.000 |
|