| ## |
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 |
454 |
116 |
21563 |
◊ |
A |
x,y,z |
1_555 |
449 |
113 |
21581 |
4375.3 |
-49.8 |
0.007 |
60 |
27 |
0 |
0.649 |
| 2 |
2 |
|
B |
55 |
17 |
21563 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
65 |
23 |
21563 |
527.4 |
-4.7 |
0.302 |
5 |
1 |
0 |
0.000 |
| 3 |
3 |
|
A |
55 |
14 |
21581 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
3_546 |
50 |
16 |
21563 |
465.4 |
3.4 |
0.867 |
11 |
3 |
0 |
0.000 |
| 4 |
4 |
|
[ATP]A:500 |
30 |
1 |
580 |
f |
A |
x,y,z |
1_555 |
48 |
19 |
21581 |
372.8 |
2.7 |
0.816 |
9 |
0 |
0 |
0.030 |
5 |
|
[ATP]B:1500 |
30 |
1 |
575 |
f |
B |
x,y,z |
1_555 |
49 |
19 |
21563 |
371.0 |
1.1 |
0.754 |
8 |
0 |
0 |
0.030 |
| Average: |
371.9 |
1.9 |
0.785 |
9 |
0 |
0 |
0.030 |
| 5 |
6 |
|
A |
30 |
12 |
21581 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
47 |
12 |
21563 |
319.4 |
-1.1 |
0.564 |
3 |
2 |
0 |
0.000 |
| 6 |
7 |
|
A |
17 |
4 |
21581 |
x |
A |
x,y,z-1 |
1_554 |
22 |
4 |
21581 |
151.6 |
-0.7 |
0.517 |
1 |
2 |
0 |
0.000 |
| 7 |
8 |
|
B |
9 |
2 |
21563 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
12 |
3 |
21581 |
75.9 |
-2.0 |
0.197 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[MN]B:1600 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
21563 |
51.8 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.030 |
10 |
|
[MN]A:600 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
21581 |
51.5 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.030 |
| Average: |
51.7 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.030 |
| 9 |
11 |
|
[ATP]A:500 |
5 |
1 |
580 |
f |
[MN]A:600 |
x,y,z |
1_555 |
1 |
1 |
123 |
49.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.059 |
12 |
|
[ATP]B:1500 |
7 |
1 |
575 |
f |
[MN]B:1600 |
x,y,z |
1_555 |
1 |
1 |
123 |
49.3 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.059 |
| Average: |
49.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.059 |
| 10 |
13 |
|
[MN]B:1601 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
21563 |
42.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.028 |
14 |
|
[MN]A:602 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
21581 |
35.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.028 |
| Average: |
39.1 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.028 |
| 11 |
15 |
|
[ATP]A:500 |
5 |
1 |
580 |
f |
[MN]A:602 |
x,y,z |
1_555 |
1 |
1 |
123 |
42.8 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.048 |
16 |
|
[ATP]B:1500 |
7 |
1 |
575 |
f |
[MN]B:1601 |
x,y,z |
1_555 |
1 |
1 |
123 |
41.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.048 |
| Average: |
42.2 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.048 |
| 12 |
17 |
|
[ATP]A:500 |
7 |
1 |
580 |
f |
[MN]A:601 |
x,y,z |
1_555 |
1 |
1 |
123 |
42.1 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.066 |
18 |
|
[ATP]B:1500 |
7 |
1 |
575 |
f |
[MN]B:1602 |
x,y,z |
1_555 |
1 |
1 |
123 |
41.7 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.066 |
| Average: |
41.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.066 |
| 13 |
19 |
|
[MN]A:601 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
21581 |
41.3 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.040 |
20 |
|
[MN]B:1602 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
21563 |
40.6 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.040 |
| Average: |
40.9 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.040 |
| 14 |
21 |
|
[MN]A:602 |
1 |
1 |
123 |
f |
[MN]A:601 |
x,y,z |
1_555 |
1 |
1 |
123 |
23.8 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.019 |
| 15 |
22 |
|
[MN]B:1602 |
1 |
1 |
123 |
f |
[MN]B:1601 |
x,y,z |
1_555 |
1 |
1 |
123 |
23.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.019 |
| 16 |
23 |
|
[MN]A:602 |
1 |
1 |
123 |
f |
[MN]A:600 |
x,y,z |
1_555 |
1 |
1 |
123 |
7.5 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.006 |
| 17 |
24 |
|
[MN]B:1601 |
1 |
1 |
123 |
f |
[MN]B:1600 |
x,y,z |
1_555 |
1 |
1 |
123 |
7.2 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.006 |
|