| ## |
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 |
435 |
110 |
22067 |
◊ |
A |
x,y,z |
1_555 |
448 |
110 |
21175 |
4179.6 |
-62.8 |
0.004 |
48 |
15 |
1 |
0.424 |
| 2 |
2 |
|
B |
54 |
17 |
22067 |
◊ |
A |
y-1,x,-z |
4_455 |
67 |
19 |
21175 |
575.4 |
-5.1 |
0.427 |
5 |
7 |
0 |
0.000 |
| 3 |
3 |
|
A |
46 |
12 |
21175 |
x |
A |
-y,x-y+1,z-1/3 |
2_564 |
48 |
12 |
21175 |
421.1 |
-0.4 |
0.728 |
11 |
5 |
0 |
0.000 |
| 4 |
4 |
|
A |
43 |
10 |
21175 |
◊ |
A |
-x,-x+y,-z-1/3 |
6_554 |
43 |
10 |
21175 |
400.4 |
-0.4 |
0.717 |
6 |
6 |
0 |
0.000 |
| 5 |
5 |
|
B |
46 |
10 |
22067 |
◊ |
B |
-x,-x+y,-z-1/3 |
6_554 |
46 |
10 |
22067 |
318.8 |
-2.0 |
0.637 |
0 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[ROL]A:804 |
20 |
1 |
470 |
f |
A |
x,y,z |
1_555 |
47 |
18 |
21175 |
309.8 |
-0.6 |
0.345 |
1 |
0 |
0 |
0.010 |
7 |
|
[ROL]B:803 |
20 |
1 |
469 |
f |
B |
x,y,z |
1_555 |
48 |
17 |
22067 |
305.0 |
-0.7 |
0.369 |
1 |
0 |
0 |
0.010 |
| Average: |
307.4 |
-0.6 |
0.357 |
1 |
0 |
0 |
0.010 |
| 7 |
8 |
|
B |
27 |
6 |
22067 |
◊ |
A |
-x,-x+y,-z-1/3 |
6_554 |
28 |
7 |
21175 |
199.1 |
-1.5 |
0.546 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[IOD]B:802 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
22067 |
86.7 |
-0.2 |
0.747 |
0 |
0 |
0 |
0.002 |
10 |
|
[IOD]A:803 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
21175 |
86.4 |
-0.2 |
0.736 |
0 |
0 |
0 |
0.002 |
| Average: |
86.5 |
-0.2 |
0.741 |
0 |
0 |
0 |
0.002 |
| 9 |
11 |
|
[ROL]B:803 |
9 |
1 |
469 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
21175 |
83.2 |
-0.2 |
0.341 |
1 |
0 |
0 |
0.006 |
12 |
|
[ROL]A:804 |
9 |
1 |
470 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
22067 |
78.6 |
-0.2 |
0.359 |
1 |
0 |
0 |
0.006 |
| Average: |
80.9 |
-0.2 |
0.350 |
1 |
0 |
0 |
0.006 |
| 10 |
13 |
|
[MG]A:805 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
21175 |
57.6 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.079 |
14 |
|
[MG]B:804 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
22067 |
55.4 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.079 |
| Average: |
56.5 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.079 |
| 11 |
15 |
|
[ZN]A:801 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
6 |
4 |
21175 |
47.5 |
-35.6 |
0.000 |
0 |
0 |
0 |
0.330 |
16 |
|
[ZN]B:801 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
22067 |
46.9 |
-34.6 |
0.000 |
0 |
0 |
0 |
0.330 |
| Average: |
47.2 |
-35.1 |
0.000 |
0 |
0 |
0 |
0.330 |
| 12 |
17 |
|
[ZN]A:802 |
1 |
1 |
98 |
f |
A |
-y,x-y+1,z-1/3 |
2_564 |
10 |
4 |
21175 |
38.6 |
-21.8 |
0.000 |
0 |
0 |
0 |
0.102 |
| 13 |
18 |
|
[ZN]A:802 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
21175 |
36.0 |
-17.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 14 |
19 |
|
[MG]B:804 |
1 |
1 |
98 |
f |
[ZN]B:801 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.2 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.026 |
| 15 |
20 |
|
[MG]A:805 |
1 |
1 |
98 |
f |
[ZN]A:801 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.020 |
|