| ## |
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 |
150 |
48 |
15173 |
◊ |
A |
x,y,z |
1_555 |
150 |
48 |
15848 |
1378.3 |
-15.1 |
0.101 |
20 |
0 |
0 |
0.176 |
| 2 |
2 |
|
A |
64 |
18 |
15848 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
70 |
23 |
15173 |
631.4 |
-7.1 |
0.185 |
2 |
2 |
0 |
0.000 |
| 3 |
3 |
|
A |
48 |
14 |
15848 |
◊ |
B |
x,y,z-1 |
1_554 |
45 |
12 |
15173 |
404.2 |
0.7 |
0.735 |
0 |
0 |
0 |
0.000 |
| 4 |
4 |
|
[MTE]B:4501 |
24 |
1 |
531 |
f |
B |
x,y,z |
1_555 |
53 |
19 |
15173 |
314.7 |
-5.8 |
0.661 |
12 |
0 |
0 |
0.165 |
5 |
|
[MTE]A:1501 |
24 |
1 |
530 |
f |
A |
x,y,z |
1_555 |
54 |
20 |
15848 |
313.8 |
-6.0 |
0.629 |
12 |
0 |
0 |
0.165 |
| Average: |
314.3 |
-5.9 |
0.645 |
12 |
0 |
0 |
0.165 |
| 5 |
6 |
|
A |
26 |
9 |
15848 |
x |
A |
x-1,y,z |
1_455 |
33 |
12 |
15848 |
280.8 |
1.2 |
0.750 |
4 |
7 |
0 |
0.000 |
| 6 |
7 |
|
A |
19 |
7 |
15848 |
◊ |
B |
x-1,y,z |
1_455 |
21 |
7 |
15173 |
166.2 |
0.2 |
0.662 |
0 |
3 |
0 |
0.000 |
| 7 |
8 |
|
B |
19 |
6 |
15173 |
x |
B |
x-1,y,z |
1_455 |
16 |
4 |
15173 |
164.8 |
2.3 |
0.828 |
2 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[SO4]B:8503 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
15173 |
99.7 |
-17.0 |
0.802 |
9 |
0 |
0 |
0.154 |
| 9 |
10 |
|
[SO4]A:7503 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
15848 |
97.4 |
-15.8 |
0.839 |
9 |
0 |
0 |
0.146 |
| 10 |
11 |
|
[SO4]B:8504 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
15173 |
75.2 |
-10.7 |
0.665 |
1 |
0 |
0 |
0.082 |
| 11 |
12 |
|
[SO4]A:7504 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
15848 |
73.7 |
-10.4 |
0.627 |
1 |
0 |
0 |
0.080 |
| 12 |
13 |
|
[MO]A:2501 |
1 |
1 |
163 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
15848 |
64.7 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.081 |
14 |
|
[MO]B:5501 |
1 |
1 |
163 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
15173 |
63.5 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.081 |
| Average: |
64.1 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.081 |
| 13 |
15 |
|
A |
8 |
3 |
15848 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
8 |
4 |
15173 |
59.5 |
-0.8 |
0.407 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[MO]A:2501 |
1 |
1 |
163 |
f |
[MTE]A:1501 |
x,y,z |
1_555 |
3 |
1 |
530 |
47.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.064 |
17 |
|
[MO]B:5501 |
1 |
1 |
163 |
f |
[MTE]B:4501 |
x,y,z |
1_555 |
3 |
1 |
531 |
47.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.064 |
| Average: |
47.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.064 |
| 15 |
18 |
|
[SO4]A:7504 |
3 |
1 |
185 |
◊ |
B |
x,y,z-1 |
1_554 |
2 |
1 |
15173 |
38.9 |
-3.7 |
0.975 |
3 |
0 |
0 |
0.000 |
| 16 |
19 |
|
A |
2 |
1 |
15848 |
◊ |
[SO4]B:8504 |
x,y,z-1 |
1_554 |
3 |
1 |
186 |
37.5 |
-3.5 |
0.975 |
3 |
0 |
0 |
0.000 |
| 17 |
20 |
|
A |
5 |
2 |
15848 |
x |
A |
x,y,z-1 |
1_554 |
3 |
1 |
15848 |
24.3 |
0.5 |
0.614 |
0 |
0 |
0 |
0.000 |
21 |
|
B |
1 |
1 |
15173 |
x |
B |
x,y,z-1 |
1_554 |
1 |
1 |
15173 |
1.0 |
-0.0 |
0.484 |
0 |
0 |
0 |
0.000 |
| Average: |
12.7 |
0.2 |
0.549 |
0 |
0 |
0 |
0.000 |
| 18 |
22 |
|
[MO]A:2501 |
1 |
1 |
163 |
f |
[SO4]A:7503 |
x,y,z |
1_555 |
4 |
1 |
184 |
17.0 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.040 |
23 |
|
[MO]B:5501 |
1 |
1 |
163 |
f |
[SO4]B:8503 |
x,y,z |
1_555 |
4 |
1 |
185 |
16.8 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.040 |
| Average: |
16.9 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.040 |
| 19 |
24 |
|
[MTE]A:1501 |
1 |
1 |
530 |
f |
[SO4]A:7503 |
x,y,z |
1_555 |
1 |
1 |
184 |
6.3 |
-1.0 |
0.447 |
0 |
0 |
0 |
0.007 |
| 20 |
25 |
|
[MTE]B:4501 |
1 |
1 |
531 |
f |
[SO4]B:8503 |
x,y,z |
1_555 |
1 |
1 |
185 |
5.5 |
-0.9 |
0.483 |
0 |
0 |
0 |
0.006 |
|