| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
106 |
29 |
12805 |
◊ |
B |
x,-y,-z |
4_555 |
106 |
29 |
12805 |
981.8 |
-9.5 |
0.267 |
4 |
4 |
0 |
0.167 |
2 |
|
A |
72 |
9 |
1459 |
◊ |
B |
x,y,z |
1_555 |
79 |
29 |
12805 |
785.4 |
-6.9 |
0.720 |
12 |
1 |
0 |
0.346 |
3 |
|
B |
69 |
27 |
12805 |
x |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
56 |
18 |
12805 |
588.6 |
3.4 |
0.896 |
5 |
2 |
0 |
0.000 |
4 |
|
B |
39 |
9 |
12805 |
x |
B |
x-1/2,-y+1/2,-z |
8_455 |
40 |
11 |
12805 |
353.9 |
-4.4 |
0.270 |
1 |
1 |
0 |
0.000 |
5 |
|
B |
26 |
8 |
12805 |
◊ |
B |
-x+1,y,-z-1/2 |
3_654 |
27 |
8 |
12805 |
214.2 |
-0.1 |
0.663 |
2 |
2 |
0 |
0.018 |
6 |
|
B |
14 |
4 |
12805 |
x |
B |
-x+1,-y,z-1/2 |
2_654 |
14 |
6 |
12805 |
123.8 |
-0.6 |
0.525 |
1 |
0 |
0 |
0.000 |
7 |
|
B |
9 |
4 |
12805 |
x |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
16 |
6 |
12805 |
97.3 |
-0.3 |
0.579 |
0 |
0 |
0 |
0.000 |
8 |
|
B |
10 |
5 |
12805 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
10 |
5 |
12805 |
74.9 |
1.7 |
0.872 |
0 |
0 |
0 |
0.000 |
9 |
|
B |
7 |
4 |
12805 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
7 |
4 |
12805 |
54.5 |
0.3 |
0.697 |
0 |
0 |
0 |
0.000 |
10 |
|
[NH2]A:10 |
1 |
1 |
117 |
cf |
A |
x,y,z |
1_555 |
7 |
2 |
1459 |
54.2 |
0.5 |
0.810 |
0 |
0 |
0 |
0.000 |
11 |
|
[CL]B:305 |
1 |
1 |
125 |
f |
B |
x,-y,-z |
4_555 |
9 |
3 |
12805 |
54.1 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.213 |
12 |
|
B |
9 |
4 |
12805 |
◊ |
B |
x,-y,-z+1 |
4_556 |
9 |
4 |
12805 |
53.4 |
-0.1 |
0.610 |
0 |
0 |
0 |
0.000 |
13 |
|
B |
6 |
3 |
12805 |
f |
[MG]B:301 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
1 |
1 |
98 |
46.1 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.167 |
14 |
|
B |
6 |
3 |
12805 |
f |
[MG]B:303 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
1 |
1 |
98 |
45.1 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.177 |
15 |
|
[MG]B:302 |
1 |
1 |
98 |
f |
[MG]B:302 |
-x+1,y,-z-1/2 |
3_654 |
1 |
1 |
98 |
43.5 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.121 |
16 |
|
[CL]B:305 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
12805 |
42.3 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.153 |
17 |
|
[MG]B:304 |
1 |
1 |
98 |
f |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
6 |
3 |
12805 |
39.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.122 |
18 |
|
[MG]B:304 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
12805 |
34.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
19 |
|
[MG]B:302 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
6 |
2 |
12805 |
33.3 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.190 |
20 |
|
A |
2 |
1 |
1459 |
◊ |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
4 |
2 |
12805 |
31.5 |
1.4 |
0.918 |
0 |
0 |
0 |
0.000 |
21 |
|
[MG]B:303 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
12805 |
30.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.000 |
22 |
|
[NH2]A:10 |
1 |
1 |
117 |
◊ |
B |
x,y,z |
1_555 |
3 |
3 |
12805 |
18.7 |
0.2 |
0.738 |
0 |
0 |
0 |
0.000 |
23 |
|
[MG]B:304 |
1 |
1 |
98 |
◊ |
B |
x,-y,-z+1 |
4_556 |
2 |
1 |
12805 |
12.1 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
|
[MG]B:301 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
12805 |
10.2 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
|
[NH2]A:10 |
1 |
1 |
117 |
◊ |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
1 |
1 |
12805 |
1.8 |
0.0 |
0.854 |
0 |
0 |
0 |
0.000 |
|