| ## |
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 |
249 |
67 |
13792 |
◊ |
A |
x,y,z |
1_555 |
256 |
69 |
14502 |
2465.6 |
-33.1 |
0.083 |
16 |
5 |
0 |
0.307 |
| 2 |
2 |
|
A |
105 |
24 |
14502 |
◊ |
A |
y,x,-z |
7_555 |
104 |
24 |
14502 |
947.3 |
-8.6 |
0.437 |
12 |
10 |
0 |
0.109 |
| 3 |
3 |
|
[ACP]A:406 |
31 |
1 |
635 |
f |
A |
x,y,z |
1_555 |
65 |
25 |
14502 |
424.9 |
-3.7 |
0.583 |
13 |
0 |
0 |
0.135 |
4 |
|
[ACP]B:403 |
31 |
1 |
628 |
f |
B |
x,y,z |
1_555 |
62 |
23 |
13792 |
417.4 |
-2.7 |
0.643 |
8 |
0 |
0 |
0.135 |
| Average: |
421.1 |
-3.2 |
0.613 |
11 |
0 |
0 |
0.135 |
| 4 |
5 |
|
A |
46 |
13 |
14502 |
◊ |
B |
-y+1/2,x+1/2,z+1/4 |
3_555 |
46 |
14 |
13792 |
416.7 |
-4.3 |
0.447 |
5 |
0 |
0 |
0.000 |
| 5 |
6 |
|
B |
38 |
10 |
13792 |
◊ |
A |
-y+1/2,x+1/2,z+1/4 |
3_555 |
38 |
11 |
14502 |
321.4 |
-1.4 |
0.680 |
1 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[DGP]A:405 |
23 |
1 |
474 |
f |
A |
x,y,z |
1_555 |
59 |
25 |
14502 |
313.8 |
-0.2 |
0.621 |
7 |
0 |
0 |
0.049 |
8 |
|
[DGP]B:401 |
23 |
1 |
471 |
f |
B |
x,y,z |
1_555 |
55 |
24 |
13792 |
312.0 |
-0.5 |
0.632 |
6 |
0 |
0 |
0.049 |
| Average: |
312.9 |
-0.4 |
0.626 |
7 |
0 |
0 |
0.049 |
| 7 |
9 |
|
A |
14 |
5 |
14502 |
x |
A |
-y+1/2,x+1/2,z+1/4 |
3_555 |
19 |
6 |
14502 |
159.3 |
-3.6 |
0.145 |
0 |
0 |
0 |
0.000 |
10 |
|
B |
13 |
4 |
13792 |
x |
B |
-y+1/2,x+1/2,z+1/4 |
3_555 |
11 |
4 |
13792 |
121.1 |
-3.8 |
0.078 |
0 |
0 |
0 |
0.000 |
| Average: |
140.2 |
-3.7 |
0.111 |
0 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[SO4]A:403 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
14502 |
104.4 |
-14.4 |
0.884 |
3 |
0 |
0 |
0.223 |
| 9 |
12 |
|
[SO4]A:401 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
14502 |
95.8 |
-12.2 |
0.961 |
8 |
0 |
0 |
0.223 |
| 10 |
13 |
|
[SO4]B:402 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
13792 |
91.0 |
-11.1 |
0.965 |
7 |
0 |
0 |
0.106 |
| 11 |
14 |
|
B |
14 |
7 |
13792 |
◊ |
B |
y-1,x+1,-z |
7_465 |
14 |
7 |
13792 |
89.6 |
1.0 |
0.857 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
A |
8 |
6 |
14502 |
◊ |
B |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
10 |
4 |
13792 |
73.0 |
-1.6 |
0.265 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[SO4]A:402 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
14502 |
70.8 |
-8.7 |
0.963 |
4 |
0 |
0 |
0.149 |
| 14 |
17 |
|
[ACP]A:406 |
5 |
1 |
635 |
f |
[DGP]A:405 |
x,y,z |
1_555 |
5 |
1 |
474 |
46.2 |
1.0 |
0.616 |
1 |
0 |
0 |
0.000 |
18 |
|
[ACP]B:403 |
5 |
1 |
628 |
f |
[DGP]B:401 |
x,y,z |
1_555 |
5 |
1 |
471 |
42.2 |
0.9 |
0.613 |
1 |
0 |
0 |
0.000 |
| Average: |
44.2 |
0.9 |
0.615 |
1 |
0 |
0 |
0.000 |
| 15 |
19 |
|
A |
13 |
4 |
14502 |
◊ |
[SO4]A:402 |
-y+1/2,x+1/2,z+1/4 |
3_555 |
4 |
1 |
185 |
45.6 |
-5.5 |
0.804 |
0 |
0 |
0 |
0.000 |
| 16 |
20 |
|
[MG]B:404 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
13792 |
40.9 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.043 |
| 17 |
21 |
|
[SO4]A:404 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
14502 |
40.2 |
-3.9 |
0.937 |
1 |
0 |
0 |
0.062 |
| 18 |
22 |
|
[DGP]B:401 |
4 |
1 |
471 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
14502 |
35.9 |
-0.1 |
0.516 |
1 |
0 |
0 |
0.008 |
23 |
|
[DGP]A:405 |
4 |
1 |
474 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
13792 |
35.5 |
-0.1 |
0.535 |
1 |
0 |
0 |
0.008 |
| Average: |
35.7 |
-0.1 |
0.526 |
1 |
0 |
0 |
0.008 |
| 19 |
24 |
|
[MG]B:404 |
1 |
1 |
98 |
f |
[ACP]B:403 |
x,y,z |
1_555 |
11 |
1 |
628 |
31.2 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.026 |
| 20 |
25 |
|
[SO4]A:404 |
2 |
1 |
183 |
◊ |
A |
y,x,-z |
7_555 |
5 |
3 |
14502 |
17.1 |
-2.4 |
0.658 |
0 |
0 |
0 |
0.033 |
| 21 |
26 |
|
[SO4]A:403 |
2 |
1 |
184 |
◊ |
[SO4]A:403 |
y,x,-z |
7_555 |
2 |
1 |
184 |
13.0 |
-3.1 |
0.960 |
0 |
0 |
0 |
0.022 |
| 22 |
27 |
|
[ACP]A:406 |
1 |
1 |
635 |
◊ |
A |
y,x,-z |
7_555 |
1 |
1 |
14502 |
9.8 |
-0.1 |
0.462 |
0 |
0 |
0 |
0.002 |
| 23 |
28 |
|
[MG]B:404 |
1 |
1 |
98 |
f |
[DGP]B:401 |
x,y,z |
1_555 |
2 |
1 |
471 |
6.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.004 |
| 24 |
29 |
|
[SO4]A:403 |
1 |
1 |
184 |
◊ |
A |
y,x,-z |
7_555 |
1 |
1 |
14502 |
0.9 |
-0.1 |
0.840 |
0 |
0 |
0 |
0.001 |
|