## |
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 |
195 |
56 |
22706 |
◊ |
A |
x,y,z |
1_555 |
193 |
58 |
22536 |
2082.8 |
-35.2 |
0.003 |
20 |
8 |
2 |
0.163 |
2 |
2 |
|
B |
130 |
37 |
22706 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
129 |
37 |
22536 |
1270.4 |
-18.7 |
0.058 |
16 |
5 |
0 |
0.088 |
3 |
3 |
|
A |
109 |
32 |
22536 |
◊ |
B |
-x+3/2,y-1/2,-z+1 |
3_646 |
113 |
30 |
22706 |
988.8 |
1.0 |
0.836 |
11 |
3 |
0 |
0.000 |
4 |
|
A |
97 |
24 |
22536 |
◊ |
B |
-x+3/2,y-1/2,-z |
3_645 |
91 |
25 |
22706 |
872.3 |
2.5 |
0.880 |
9 |
4 |
0 |
0.000 |
Average: |
930.6 |
1.8 |
0.858 |
10 |
4 |
0 |
0.000 |
4 |
5 |
|
A |
39 |
12 |
22536 |
x |
A |
-x+3/2,y-1/2,-z |
3_645 |
43 |
14 |
22536 |
411.8 |
-2.4 |
0.517 |
3 |
3 |
0 |
0.000 |
6 |
|
B |
32 |
10 |
22706 |
x |
B |
-x+3/2,y-1/2,-z+1 |
3_646 |
35 |
10 |
22706 |
334.2 |
-2.2 |
0.496 |
2 |
1 |
0 |
0.000 |
Average: |
373.0 |
-2.3 |
0.507 |
3 |
2 |
0 |
0.000 |
5 |
7 |
|
[ADP]A:601 |
27 |
1 |
516 |
f |
A |
x,y,z |
1_555 |
48 |
22 |
22536 |
364.6 |
-3.5 |
0.664 |
9 |
0 |
0 |
0.049 |
8 |
|
[ADP]B:601 |
27 |
1 |
519 |
f |
B |
x,y,z |
1_555 |
47 |
22 |
22706 |
359.6 |
-3.7 |
0.651 |
8 |
0 |
0 |
0.049 |
Average: |
362.1 |
-3.6 |
0.657 |
9 |
0 |
0 |
0.049 |
6 |
9 |
|
[K]B:603 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
17 |
12 |
22706 |
121.2 |
-100.6 |
0.000 |
0 |
0 |
0 |
0.670 |
10 |
|
[K]A:603 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
16 |
12 |
22536 |
120.7 |
-100.7 |
0.000 |
0 |
0 |
0 |
0.670 |
Average: |
120.9 |
-100.6 |
0.000 |
0 |
0 |
0 |
0.670 |
7 |
11 |
|
[CL]A:604 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
22536 |
74.5 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.077 |
12 |
|
[CL]B:604 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
22706 |
74.0 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.077 |
Average: |
74.3 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.077 |
8 |
13 |
|
B |
9 |
3 |
22706 |
x |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
8 |
3 |
22706 |
67.4 |
-0.5 |
0.456 |
0 |
0 |
0 |
0.000 |
14 |
|
A |
3 |
2 |
22536 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
22536 |
7.9 |
-0.1 |
0.554 |
0 |
0 |
0 |
0.000 |
Average: |
37.6 |
-0.3 |
0.505 |
0 |
0 |
0 |
0.000 |
9 |
15 |
|
[MG]A:602 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
22536 |
46.3 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.029 |
16 |
|
[MG]B:602 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
6 |
22706 |
40.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
43.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.029 |
10 |
17 |
|
[MG]A:602 |
1 |
1 |
98 |
f |
[ADP]A:601 |
x,y,z |
1_555 |
5 |
1 |
516 |
38.6 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.042 |
18 |
|
[MG]B:602 |
1 |
1 |
98 |
f |
[ADP]B:601 |
x,y,z |
1_555 |
2 |
1 |
519 |
37.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.042 |
Average: |
38.0 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.042 |
11 |
19 |
|
A |
3 |
2 |
22536 |
◊ |
B |
x,y,z-1 |
1_554 |
4 |
2 |
22706 |
30.0 |
0.6 |
0.631 |
0 |
0 |
0 |
0.000 |
12 |
20 |
|
[K]A:603 |
1 |
1 |
216 |
f |
[ADP]A:601 |
x,y,z |
1_555 |
5 |
1 |
516 |
13.7 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.045 |
21 |
|
[K]B:603 |
1 |
1 |
216 |
f |
[ADP]B:601 |
x,y,z |
1_555 |
5 |
1 |
519 |
11.9 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.045 |
Average: |
12.8 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.045 |
|