| ## |
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 |
78 |
22 |
17599 |
◊ |
A |
x,y,z |
1_555 |
84 |
22 |
17580 |
748.0 |
-3.6 |
0.269 |
11 |
0 |
0 |
0.083 |
| 2 |
2 |
|
A |
75 |
20 |
17580 |
x |
A |
x,y,z-1 |
1_554 |
76 |
22 |
17580 |
683.5 |
4.5 |
0.772 |
7 |
9 |
0 |
0.000 |
| 3 |
3 |
|
B |
51 |
14 |
17599 |
◊ |
B |
-x+3,-y,z |
2_855 |
52 |
15 |
17599 |
516.6 |
0.3 |
0.582 |
6 |
0 |
0 |
0.000 |
| 4 |
4 |
|
B |
38 |
15 |
17599 |
◊ |
B |
-x+2,-y,z |
2_755 |
38 |
15 |
17599 |
342.1 |
6.8 |
0.954 |
6 |
2 |
0 |
0.000 |
| 5 |
5 |
|
A |
21 |
7 |
17580 |
x |
A |
x-1/2,-y+1/2,-z+2 |
4_457 |
30 |
13 |
17580 |
248.0 |
0.9 |
0.599 |
5 |
0 |
0 |
0.000 |
| 6 |
6 |
|
A |
32 |
9 |
17580 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
24 |
10 |
17599 |
225.5 |
1.4 |
0.670 |
2 |
1 |
0 |
0.000 |
| 7 |
7 |
|
A |
27 |
11 |
17580 |
◊ |
B |
x-1,y,z |
1_455 |
24 |
9 |
17599 |
221.0 |
2.9 |
0.803 |
2 |
0 |
0 |
0.000 |
| 8 |
8 |
|
A |
28 |
11 |
17580 |
◊ |
B |
x-1,y,z+1 |
1_456 |
21 |
7 |
17599 |
191.7 |
-1.0 |
0.386 |
0 |
0 |
0 |
0.000 |
| 9 |
9 |
|
[SO4]B:1426 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
17599 |
123.1 |
-15.2 |
0.809 |
8 |
0 |
0 |
0.184 |
| 10 |
10 |
|
[SO4]A:1429 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
17580 |
119.8 |
-17.6 |
0.589 |
3 |
0 |
0 |
0.186 |
| 11 |
11 |
|
[SO4]B:1427 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
17599 |
117.8 |
-18.4 |
0.659 |
4 |
0 |
0 |
0.198 |
| 12 |
12 |
|
A |
17 |
7 |
17580 |
◊ |
B |
x-1/2,-y+1/2,-z+2 |
4_457 |
16 |
8 |
17599 |
116.3 |
2.1 |
0.742 |
2 |
0 |
0 |
0.000 |
| 13 |
13 |
|
[EDO]A:1430 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
10 |
17580 |
97.4 |
2.4 |
0.246 |
2 |
0 |
0 |
0.000 |
| 14 |
14 |
|
[SO4]B:1428 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
17599 |
83.0 |
-12.0 |
0.800 |
3 |
0 |
0 |
0.131 |
| 15 |
15 |
|
[SO4]A:1428 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
17580 |
82.8 |
-11.4 |
0.871 |
4 |
0 |
0 |
0.129 |
| 16 |
16 |
|
B |
14 |
6 |
17599 |
x |
B |
x,y,z-1 |
1_554 |
9 |
4 |
17599 |
59.4 |
0.8 |
0.701 |
0 |
0 |
0 |
0.000 |
| 17 |
17 |
|
B |
5 |
3 |
17599 |
◊ |
A |
x,y,z-1 |
1_554 |
5 |
4 |
17580 |
49.1 |
1.5 |
0.814 |
1 |
1 |
0 |
0.000 |
| 18 |
18 |
|
[MG]A:1427 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
7 |
5 |
17580 |
35.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.093 |
19 |
|
[MG]A:1427 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
7 |
5 |
17599 |
35.2 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.093 |
| Average: |
35.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.093 |
| 19 |
20 |
|
[EDO]A:1430 |
2 |
1 |
185 |
f |
[SO4]A:1429 |
x,y,z |
1_555 |
1 |
1 |
184 |
10.7 |
-1.2 |
0.894 |
0 |
0 |
0 |
0.012 |
|