| ## |
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 |
306 |
80 |
20398 |
◊ |
A |
x,y,z |
1_555 |
299 |
80 |
20341 |
2874.4 |
-42.3 |
0.013 |
23 |
0 |
0 |
1.000 |
2 |
|
D |
296 |
78 |
20798 |
◊ |
C |
x,y,z |
1_555 |
298 |
79 |
18136 |
2827.5 |
-42.7 |
0.021 |
22 |
0 |
0 |
1.000 |
| Average: |
2851.0 |
-42.5 |
0.017 |
23 |
0 |
0 |
1.000 |
| 2 |
3 |
|
D |
265 |
70 |
20798 |
◊ |
A |
x,y,z |
1_555 |
268 |
67 |
20341 |
2368.1 |
-30.5 |
0.113 |
21 |
0 |
0 |
0.731 |
4 |
|
C |
271 |
69 |
18136 |
◊ |
B |
x,y,z |
1_555 |
261 |
67 |
20398 |
2355.2 |
-30.4 |
0.111 |
21 |
0 |
0 |
0.731 |
| Average: |
2361.6 |
-30.4 |
0.112 |
21 |
0 |
0 |
0.731 |
| 3 |
5 |
|
D |
179 |
45 |
20798 |
◊ |
B |
x,y,z |
1_555 |
186 |
49 |
20398 |
1780.0 |
-11.7 |
0.527 |
35 |
4 |
0 |
0.637 |
6 |
|
C |
148 |
38 |
18136 |
◊ |
A |
x,y,z |
1_555 |
165 |
45 |
20341 |
1463.2 |
-10.7 |
0.503 |
30 |
4 |
0 |
0.637 |
| Average: |
1621.6 |
-11.2 |
0.515 |
33 |
4 |
0 |
0.637 |
| 4 |
7 |
|
C |
23 |
9 |
18136 |
◊ |
A |
-x-1/2,-y+2,z-1/2 |
2_474 |
24 |
8 |
20341 |
235.2 |
-0.8 |
0.621 |
5 |
0 |
0 |
0.000 |
| 5 |
8 |
|
A |
30 |
12 |
20341 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
29 |
12 |
20398 |
223.4 |
1.6 |
0.861 |
6 |
3 |
0 |
0.000 |
| 6 |
9 |
|
B |
23 |
8 |
20398 |
◊ |
C |
x-1/2,-y+3/2,-z |
4_465 |
26 |
8 |
18136 |
189.9 |
-1.9 |
0.475 |
0 |
0 |
0 |
0.000 |
| 7 |
10 |
|
A |
22 |
5 |
20341 |
◊ |
D |
x-1/2,-y+3/2,-z+1 |
4_466 |
9 |
5 |
20798 |
120.3 |
-0.4 |
0.632 |
0 |
1 |
0 |
0.000 |
| 8 |
11 |
|
[SO4]D:501 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
20798 |
91.5 |
-14.8 |
0.746 |
5 |
0 |
0 |
0.283 |
| 9 |
12 |
|
B |
10 |
3 |
20398 |
◊ |
D |
x-1/2,-y+3/2,-z |
4_465 |
7 |
4 |
20798 |
81.4 |
1.3 |
0.850 |
1 |
3 |
0 |
0.000 |
| 10 |
13 |
|
B |
9 |
5 |
20398 |
x |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
8 |
6 |
20398 |
69.1 |
-0.2 |
0.488 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
D |
10 |
4 |
20798 |
x |
D |
x-1/2,-y+3/2,-z |
4_465 |
10 |
4 |
20798 |
69.1 |
0.4 |
0.635 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
[SO4]D:502 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
20798 |
55.3 |
-6.8 |
0.893 |
2 |
0 |
0 |
0.128 |
| 13 |
16 |
|
[SO4]C:501 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
18136 |
53.0 |
-6.7 |
0.918 |
2 |
0 |
0 |
0.196 |
| 14 |
17 |
|
[SO4]D:502 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
11 |
7 |
20341 |
48.9 |
-6.5 |
0.858 |
1 |
0 |
0 |
0.097 |
| 15 |
18 |
|
[SO4]C:501 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
10 |
6 |
20398 |
48.2 |
-6.6 |
0.836 |
1 |
0 |
0 |
0.130 |
| 16 |
19 |
|
[SO4]D:502 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
20398 |
44.9 |
-6.6 |
0.546 |
2 |
0 |
0 |
0.124 |
| 17 |
20 |
|
D |
6 |
4 |
20798 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
3 |
20398 |
43.8 |
0.2 |
0.536 |
0 |
0 |
0 |
0.000 |
21 |
|
A |
6 |
3 |
20341 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
4 |
18136 |
30.5 |
-0.1 |
0.594 |
0 |
0 |
0 |
0.000 |
| Average: |
37.2 |
0.1 |
0.565 |
0 |
0 |
0 |
0.000 |
| 18 |
22 |
|
[SO4]C:501 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
20341 |
42.0 |
-6.0 |
0.550 |
1 |
0 |
0 |
0.166 |
| 19 |
23 |
|
B |
2 |
1 |
20398 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
20341 |
30.5 |
1.5 |
0.953 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
A |
2 |
2 |
20341 |
◊ |
D |
x-1,y,z |
1_455 |
4 |
2 |
20798 |
10.4 |
0.3 |
0.785 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
C |
2 |
2 |
18136 |
◊ |
B |
-x-1/2,-y+2,z-1/2 |
2_474 |
3 |
2 |
20398 |
9.7 |
0.5 |
0.832 |
0 |
0 |
0 |
0.000 |
|