| ## |
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 |
189 |
45 |
8464 |
◊ |
A |
x,y,z |
1_555 |
198 |
45 |
8471 |
1843.2 |
-19.7 |
0.246 |
37 |
0 |
2 |
0.436 |
| 2 |
2 |
|
[UPA]B:126 |
32 |
1 |
729 |
f |
B |
x,y,z |
1_555 |
47 |
17 |
8464 |
359.5 |
0.4 |
0.757 |
9 |
0 |
0 |
0.056 |
3 |
|
[UPA]A:125 |
32 |
1 |
726 |
f |
A |
x,y,z |
1_555 |
44 |
16 |
8471 |
346.9 |
1.0 |
0.785 |
7 |
0 |
0 |
0.056 |
| Average: |
353.2 |
0.7 |
0.771 |
8 |
0 |
0 |
0.056 |
| 3 |
4 |
|
B |
32 |
11 |
8464 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
34 |
11 |
8471 |
298.4 |
-3.8 |
0.341 |
0 |
0 |
0 |
0.000 |
| 4 |
5 |
|
B |
25 |
9 |
8464 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
28 |
12 |
8471 |
250.9 |
-1.0 |
0.566 |
2 |
0 |
0 |
0.000 |
| 5 |
6 |
|
B |
31 |
10 |
8464 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
25 |
7 |
8471 |
247.1 |
-0.4 |
0.641 |
4 |
0 |
0 |
0.000 |
| 6 |
7 |
|
A |
12 |
5 |
8471 |
x |
A |
-x,y-1/2,-z |
2_545 |
16 |
5 |
8471 |
130.1 |
-2.3 |
0.267 |
1 |
0 |
0 |
0.000 |
8 |
|
B |
16 |
4 |
8464 |
x |
B |
-x,y-1/2,-z |
2_545 |
11 |
5 |
8464 |
127.1 |
-2.0 |
0.284 |
1 |
0 |
0 |
0.000 |
| Average: |
128.6 |
-2.2 |
0.276 |
1 |
0 |
0 |
0.000 |
| 7 |
9 |
|
B |
13 |
3 |
8464 |
x |
B |
x-1,y,z |
1_455 |
15 |
5 |
8464 |
109.4 |
-1.3 |
0.411 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[UPA]A:125 |
11 |
1 |
726 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
8464 |
88.6 |
-1.4 |
0.503 |
2 |
0 |
0 |
0.048 |
11 |
|
[UPA]B:126 |
9 |
1 |
729 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
8471 |
84.3 |
-1.7 |
0.436 |
2 |
0 |
0 |
0.048 |
| Average: |
86.4 |
-1.5 |
0.469 |
2 |
0 |
0 |
0.048 |
| 9 |
12 |
|
[UPA]B:126 |
11 |
1 |
729 |
◊ |
[UPA]A:125 |
-x,y-1/2,-z |
2_545 |
11 |
1 |
726 |
87.9 |
-2.7 |
0.414 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
A |
7 |
1 |
8471 |
x |
A |
x-1,y,z-1 |
1_454 |
8 |
3 |
8471 |
82.0 |
0.8 |
0.771 |
1 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[SO4]B:129 |
5 |
1 |
187 |
f |
B |
x-1,y,z |
1_455 |
9 |
4 |
8464 |
76.7 |
-10.2 |
0.819 |
4 |
0 |
0 |
0.118 |
| 12 |
15 |
|
A |
9 |
5 |
8471 |
◊ |
B |
x-1,y,z |
1_455 |
7 |
2 |
8464 |
72.1 |
-0.6 |
0.432 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[UPA]B:126 |
9 |
1 |
729 |
f |
[SO4]B:128 |
x,y,z |
1_555 |
5 |
1 |
187 |
70.6 |
-9.1 |
0.804 |
0 |
0 |
0 |
0.090 |
| 14 |
17 |
|
[UPA]A:125 |
10 |
1 |
726 |
f |
[SO4]A:127 |
x,y,z |
1_555 |
5 |
1 |
188 |
68.8 |
-8.7 |
0.800 |
0 |
0 |
0 |
0.086 |
| 15 |
18 |
|
[SO4]A:127 |
4 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
8471 |
60.6 |
-7.8 |
0.747 |
1 |
0 |
0 |
0.082 |
| 16 |
19 |
|
[SO4]B:128 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
8464 |
59.1 |
-7.6 |
0.755 |
2 |
0 |
0 |
0.084 |
| 17 |
20 |
|
[SO4]B:129 |
5 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
8464 |
54.9 |
-7.1 |
0.776 |
3 |
0 |
0 |
0.000 |
| 18 |
21 |
|
A |
4 |
3 |
8471 |
x |
A |
-x-1,y-1/2,-z |
2_445 |
7 |
3 |
8471 |
51.5 |
-1.2 |
0.252 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
A |
7 |
3 |
8471 |
◊ |
[SO4]A:127 |
-x,y-1/2,-z |
2_545 |
5 |
1 |
188 |
44.2 |
-4.3 |
0.822 |
0 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[SO4]B:128 |
4 |
1 |
187 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
5 |
3 |
8464 |
41.0 |
-2.7 |
0.973 |
1 |
0 |
0 |
0.000 |
| 21 |
24 |
|
B |
5 |
2 |
8464 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
8 |
2 |
8471 |
35.1 |
-0.4 |
0.532 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
A |
2 |
2 |
8471 |
x |
A |
x-1,y,z |
1_455 |
3 |
2 |
8471 |
28.6 |
-0.5 |
0.372 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
A |
5 |
3 |
8471 |
◊ |
[UPA]A:125 |
-x,y-1/2,-z |
2_545 |
7 |
1 |
726 |
28.2 |
0.6 |
0.695 |
1 |
0 |
0 |
0.000 |
27 |
|
[UPA]B:126 |
5 |
1 |
729 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
4 |
3 |
8464 |
16.6 |
-0.0 |
0.607 |
0 |
0 |
0 |
0.000 |
| Average: |
22.4 |
0.3 |
0.651 |
1 |
0 |
0 |
0.000 |
| 24 |
28 |
|
B |
4 |
2 |
8464 |
◊ |
[UPA]A:125 |
-x,y-1/2,-z |
2_545 |
3 |
1 |
726 |
25.3 |
1.1 |
0.815 |
0 |
0 |
0 |
0.000 |
29 |
|
[UPA]B:126 |
3 |
1 |
729 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
3 |
2 |
8471 |
23.0 |
1.0 |
0.815 |
0 |
0 |
0 |
0.000 |
| Average: |
24.1 |
1.0 |
0.815 |
0 |
0 |
0 |
0.000 |
|