| ## |
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 |
|
A |
56 |
18 |
9193 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
56 |
14 |
9082 |
543.2 |
-7.2 |
0.229 |
3 |
2 |
0 |
0.000 |
| 2 |
2 |
|
B |
39 |
10 |
9082 |
◊ |
A |
x,y,z |
1_555 |
39 |
11 |
9193 |
359.1 |
-1.5 |
0.609 |
9 |
4 |
1 |
0.013 |
| 3 |
3 |
|
[ADP]A:201 |
27 |
1 |
565 |
f |
A |
x,y,z |
1_555 |
49 |
14 |
9193 |
335.3 |
-5.4 |
0.645 |
11 |
0 |
0 |
0.030 |
4 |
|
[ADP]B:202 |
27 |
1 |
560 |
f |
B |
x,y,z |
1_555 |
52 |
14 |
9082 |
333.2 |
-5.6 |
0.649 |
10 |
0 |
0 |
0.030 |
| Average: |
334.2 |
-5.5 |
0.647 |
11 |
0 |
0 |
0.030 |
| 4 |
5 |
|
A |
41 |
14 |
9193 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
29 |
10 |
9193 |
311.9 |
-3.2 |
0.345 |
3 |
0 |
0 |
0.000 |
| 5 |
6 |
|
B |
17 |
4 |
9082 |
◊ |
A |
x-1,y,z |
1_455 |
18 |
4 |
9193 |
149.9 |
1.4 |
0.833 |
1 |
1 |
0 |
0.000 |
| 6 |
7 |
|
[PO4]B:302 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
9082 |
112.1 |
-7.3 |
0.723 |
8 |
0 |
0 |
0.031 |
| 7 |
8 |
|
[PO4]A:301 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
9193 |
111.5 |
-7.1 |
0.723 |
6 |
0 |
0 |
0.029 |
| 8 |
9 |
|
B |
14 |
5 |
9082 |
◊ |
A |
x-1/2,-y+3/2,-z |
4_465 |
10 |
5 |
9193 |
102.1 |
-0.5 |
0.495 |
0 |
0 |
0 |
0.000 |
| 9 |
10 |
|
A |
13 |
3 |
9193 |
◊ |
[ADP]B:202 |
-x,y-1/2,-z+1/2 |
3_545 |
11 |
1 |
560 |
97.7 |
-0.4 |
0.534 |
0 |
0 |
0 |
0.000 |
| 10 |
11 |
|
B |
16 |
7 |
9082 |
x |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
15 |
6 |
9082 |
96.6 |
-0.3 |
0.634 |
0 |
0 |
0 |
0.000 |
| 11 |
12 |
|
A |
11 |
3 |
9193 |
◊ |
B |
x,y-1,z |
1_545 |
12 |
4 |
9082 |
92.5 |
-0.0 |
0.573 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
B |
12 |
6 |
9082 |
x |
B |
x-1/2,-y+3/2,-z |
4_465 |
9 |
3 |
9082 |
87.8 |
-2.0 |
0.230 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
A |
9 |
3 |
9193 |
◊ |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
16 |
7 |
9082 |
85.6 |
-1.8 |
0.236 |
0 |
0 |
0 |
0.000 |
| 14 |
15 |
|
[MG]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
9193 |
46.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.017 |
16 |
|
[MG]B:402 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
9082 |
45.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.017 |
| Average: |
45.9 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.017 |
| 15 |
17 |
|
B |
3 |
1 |
9082 |
◊ |
A |
x-1,y+1,z |
1_465 |
3 |
1 |
9193 |
33.9 |
0.5 |
0.678 |
0 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[ADP]A:201 |
3 |
1 |
565 |
f |
[PO4]A:301 |
x,y,z |
1_555 |
4 |
1 |
187 |
33.5 |
-3.1 |
0.539 |
0 |
0 |
0 |
0.009 |
| 17 |
19 |
|
[ADP]B:202 |
6 |
1 |
560 |
f |
[MG]B:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.8 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.015 |
20 |
|
[ADP]A:201 |
4 |
1 |
565 |
f |
[MG]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.5 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.015 |
| Average: |
32.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.015 |
| 18 |
21 |
|
[ADP]B:202 |
3 |
1 |
560 |
f |
[PO4]B:302 |
x,y,z |
1_555 |
4 |
1 |
185 |
30.5 |
-3.0 |
0.569 |
0 |
0 |
0 |
0.009 |
| 19 |
22 |
|
[ADP]A:201 |
2 |
1 |
565 |
◊ |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
1 |
1 |
9082 |
7.9 |
0.1 |
0.410 |
0 |
0 |
0 |
0.000 |
|