| ## |
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 |
73 |
21 |
12738 |
x |
B |
z+1,x-1,y |
5_645 |
75 |
24 |
12738 |
683.4 |
-6.3 |
0.176 |
3 |
2 |
0 |
0.000 |
| 2 |
2 |
|
A |
60 |
14 |
12604 |
x |
A |
-z+1,x-1/2,-y+1/2 |
8_645 |
53 |
11 |
12604 |
502.7 |
-1.9 |
0.385 |
5 |
3 |
0 |
0.000 |
| 3 |
3 |
|
[CDM]A:1269 |
32 |
1 |
641 |
f |
A |
x,y,z |
1_555 |
64 |
25 |
12604 |
424.1 |
-5.3 |
0.505 |
17 |
0 |
0 |
0.021 |
4 |
|
[CDM]B:1269 |
32 |
1 |
641 |
f |
B |
x,y,z |
1_555 |
56 |
21 |
12738 |
418.4 |
-3.5 |
0.587 |
11 |
0 |
0 |
0.021 |
| Average: |
421.2 |
-4.4 |
0.546 |
14 |
0 |
0 |
0.021 |
| 4 |
5 |
|
B |
46 |
13 |
12738 |
◊ |
A |
x,y,z |
1_555 |
44 |
13 |
12604 |
386.2 |
-0.1 |
0.593 |
4 |
8 |
0 |
0.000 |
| 5 |
6 |
|
A |
38 |
10 |
12604 |
◊ |
B |
z+1/2,-x+3/2,-y+1 |
6_566 |
43 |
13 |
12738 |
354.5 |
0.3 |
0.624 |
3 |
2 |
0 |
0.000 |
| 6 |
7 |
|
[ADP]A:1270 |
25 |
1 |
541 |
f |
A |
x,y,z |
1_555 |
54 |
27 |
12604 |
338.3 |
-5.0 |
0.510 |
11 |
0 |
0 |
0.020 |
8 |
|
[ADP]B:1270 |
23 |
1 |
540 |
f |
B |
x,y,z |
1_555 |
52 |
27 |
12738 |
336.4 |
-5.3 |
0.485 |
11 |
0 |
0 |
0.020 |
| Average: |
337.3 |
-5.1 |
0.498 |
11 |
0 |
0 |
0.020 |
| 7 |
9 |
|
A |
37 |
11 |
12604 |
x |
A |
z+1/2,-x+3/2,-y+1 |
6_566 |
35 |
12 |
12604 |
310.8 |
1.4 |
0.684 |
2 |
2 |
0 |
0.000 |
| 8 |
10 |
|
[SO4]A:1271 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
12604 |
79.5 |
-10.9 |
0.809 |
1 |
0 |
0 |
0.019 |
| 9 |
11 |
|
[SO4]B:1271 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
12738 |
75.6 |
-9.4 |
0.952 |
5 |
0 |
0 |
0.023 |
| 10 |
12 |
|
[SO4]A:1272 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
12604 |
75.2 |
-11.3 |
0.718 |
3 |
0 |
0 |
0.021 |
| 11 |
13 |
|
[CL]B:1273 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
12738 |
71.3 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.022 |
14 |
|
[CL]A:1273 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
12604 |
70.3 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.022 |
| Average: |
70.8 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.022 |
| 12 |
15 |
|
[CL]B:1272 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
12738 |
62.6 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.018 |
| 13 |
16 |
|
B |
7 |
4 |
12738 |
◊ |
[ADP]B:1270 |
z+1,x-1,y |
5_645 |
6 |
1 |
540 |
48.0 |
-0.6 |
0.475 |
0 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[ADP]A:1270 |
6 |
1 |
541 |
f |
[CDM]A:1269 |
x,y,z |
1_555 |
4 |
1 |
641 |
30.3 |
-2.7 |
0.442 |
0 |
0 |
0 |
0.004 |
| 15 |
18 |
|
[SO4]A:1271 |
4 |
1 |
185 |
◊ |
A |
-z+1,x-1/2,-y+1/2 |
8_645 |
2 |
1 |
12604 |
26.3 |
-2.2 |
0.957 |
1 |
0 |
0 |
0.000 |
| 16 |
19 |
|
[ADP]B:1270 |
2 |
1 |
540 |
f |
[CDM]B:1269 |
x,y,z |
1_555 |
1 |
1 |
641 |
9.9 |
-0.4 |
0.508 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[SO4]B:1271 |
1 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12604 |
4.1 |
-0.5 |
0.871 |
0 |
0 |
0 |
0.000 |
|