| ## |
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 |
|
D |
124 |
31 |
4009 |
◊ |
C |
x,y,z |
1_555 |
119 |
31 |
4049 |
1244.3 |
-16.9 |
0.215 |
15 |
10 |
0 |
0.652 |
2 |
|
B |
123 |
31 |
3935 |
◊ |
A |
x,y,z |
1_555 |
119 |
31 |
3975 |
1236.4 |
-19.3 |
0.173 |
13 |
6 |
0 |
0.652 |
| Average: |
1240.3 |
-18.1 |
0.194 |
14 |
8 |
0 |
0.652 |
| 2 |
3 |
|
C |
34 |
12 |
4049 |
◊ |
A |
x,y,z |
1_555 |
36 |
12 |
3975 |
290.5 |
0.1 |
0.758 |
4 |
2 |
0 |
0.010 |
4 |
|
D |
34 |
13 |
4009 |
◊ |
D |
-x+1,y,-z |
2_655 |
34 |
13 |
4009 |
269.5 |
-0.2 |
0.749 |
4 |
2 |
0 |
0.010 |
| Average: |
280.0 |
-0.1 |
0.753 |
4 |
2 |
0 |
0.010 |
| 3 |
5 |
|
B |
22 |
8 |
3935 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
22 |
5 |
4049 |
207.9 |
-0.9 |
0.565 |
2 |
4 |
0 |
0.059 |
6 |
|
D |
21 |
5 |
4009 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
20 |
8 |
4049 |
186.6 |
-1.3 |
0.528 |
1 |
2 |
0 |
0.059 |
7 |
|
A |
21 |
5 |
3975 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
19 |
7 |
4009 |
170.0 |
-1.4 |
0.522 |
0 |
0 |
0 |
0.059 |
| Average: |
188.2 |
-1.2 |
0.538 |
1 |
2 |
0 |
0.059 |
| 4 |
8 |
|
D |
18 |
4 |
4009 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
18 |
4 |
4009 |
160.6 |
2.9 |
0.928 |
4 |
4 |
0 |
0.000 |
9 |
|
A |
17 |
4 |
3975 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
17 |
4 |
4049 |
150.9 |
2.7 |
0.908 |
4 |
5 |
0 |
0.000 |
| Average: |
155.8 |
2.8 |
0.918 |
4 |
5 |
0 |
0.000 |
| 5 |
10 |
|
C |
18 |
6 |
4049 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
18 |
6 |
4049 |
136.8 |
-0.9 |
0.593 |
2 |
0 |
0 |
0.027 |
11 |
|
B |
19 |
6 |
3935 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
17 |
6 |
4009 |
132.1 |
-0.9 |
0.619 |
2 |
0 |
0 |
0.027 |
| Average: |
134.4 |
-0.9 |
0.606 |
2 |
0 |
0 |
0.027 |
| 6 |
12 |
|
B |
13 |
3 |
3935 |
◊ |
B |
-x+1,y,-z+1 |
2_656 |
13 |
3 |
3935 |
117.0 |
1.5 |
0.845 |
0 |
0 |
0 |
0.000 |
| 7 |
13 |
|
D |
11 |
4 |
4009 |
◊ |
B |
-x+1,y,-z+1 |
2_656 |
11 |
3 |
3935 |
91.0 |
-0.6 |
0.596 |
1 |
0 |
0 |
0.000 |
14 |
|
A |
10 |
4 |
3975 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
10 |
3 |
4049 |
90.0 |
-0.9 |
0.550 |
1 |
0 |
0 |
0.000 |
| Average: |
90.5 |
-0.8 |
0.573 |
1 |
0 |
0 |
0.000 |
| 8 |
15 |
|
[SO4]B:402 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
3935 |
90.6 |
-13.5 |
0.805 |
6 |
0 |
0 |
0.385 |
| 9 |
16 |
|
[SO4]C:401 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
4049 |
73.5 |
-10.4 |
0.745 |
5 |
0 |
0 |
0.330 |
| 10 |
17 |
|
[GOL]D:400 |
6 |
1 |
211 |
◊ |
D |
-x+1,y,-z |
2_655 |
13 |
6 |
4009 |
66.4 |
-0.3 |
0.581 |
3 |
0 |
0 |
0.016 |
| 11 |
18 |
|
[SO4]C:401 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
3975 |
52.7 |
-6.3 |
0.867 |
2 |
0 |
0 |
0.035 |
| 12 |
19 |
|
D |
8 |
3 |
4009 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
9 |
4 |
3975 |
49.6 |
0.0 |
0.685 |
0 |
0 |
0 |
0.000 |
20 |
|
A |
9 |
3 |
3975 |
◊ |
D |
-x+1/2,y-1/2,-z |
4_545 |
7 |
4 |
4009 |
37.0 |
0.1 |
0.669 |
0 |
0 |
0 |
0.000 |
| Average: |
43.3 |
0.0 |
0.677 |
0 |
0 |
0 |
0.000 |
| 13 |
21 |
|
[GOL]D:400 |
5 |
1 |
211 |
◊ |
D |
x,y,z |
1_555 |
7 |
4 |
4009 |
42.6 |
0.2 |
0.591 |
1 |
0 |
0 |
0.000 |
| 14 |
22 |
|
[SO4]B:402 |
4 |
1 |
186 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
3 |
1 |
4049 |
42.4 |
-3.8 |
0.964 |
2 |
0 |
0 |
0.048 |
| 15 |
23 |
|
A |
4 |
1 |
3975 |
cf |
[GOL]D:400 |
-x+1/2,y-1/2,-z |
4_545 |
5 |
1 |
211 |
39.7 |
1.1 |
0.711 |
0 |
0 |
0 |
0.000 |
| 16 |
24 |
|
[SO4]C:401 |
4 |
1 |
185 |
◊ |
D |
-x+1,y,-z+1 |
2_656 |
3 |
1 |
4009 |
36.9 |
-2.7 |
0.968 |
2 |
0 |
0 |
0.037 |
| 17 |
25 |
|
[GOL]D:400 |
5 |
1 |
211 |
c |
[GOL]D:400 |
-x+1,y,-z |
2_655 |
5 |
1 |
211 |
35.1 |
-0.6 |
0.419 |
0 |
0 |
0 |
0.000 |
| 18 |
26 |
|
B |
1 |
1 |
3935 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
8 |
3 |
3975 |
20.3 |
0.4 |
0.809 |
0 |
0 |
0 |
0.000 |
| 19 |
27 |
|
A |
2 |
1 |
3975 |
◊ |
[GOL]D:400 |
x-1/2,y-1/2,z |
3_445 |
3 |
1 |
211 |
18.4 |
0.2 |
0.667 |
1 |
0 |
0 |
0.000 |
| 20 |
28 |
|
A |
3 |
1 |
3975 |
◊ |
A |
-x,y,-z |
2_555 |
3 |
1 |
3975 |
12.9 |
0.3 |
0.773 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
[GOL]D:400 |
2 |
1 |
211 |
◊ |
C |
-x+1,y,-z |
2_655 |
1 |
1 |
4049 |
10.3 |
0.1 |
0.592 |
0 |
0 |
0 |
0.000 |
| 22 |
30 |
|
[SO4]B:402 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
3975 |
8.4 |
-1.0 |
0.806 |
0 |
0 |
0 |
0.023 |
| 23 |
31 |
|
[SO4]C:401 |
1 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
4009 |
6.9 |
-0.7 |
0.801 |
0 |
0 |
0 |
0.018 |
|