| ## |
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 |
222 |
53 |
18089 |
◊ |
A |
x,y,z |
1_555 |
227 |
52 |
18335 |
2219.5 |
-48.7 |
0.000 |
13 |
0 |
0 |
0.283 |
| 2 |
2 |
|
A |
60 |
17 |
18335 |
x |
A |
x-1,y,z |
1_455 |
81 |
26 |
18335 |
609.6 |
-2.8 |
0.416 |
5 |
5 |
0 |
0.000 |
| 3 |
3 |
|
B |
44 |
15 |
18089 |
◊ |
A |
x,y,z-1 |
1_554 |
45 |
15 |
18335 |
389.5 |
-1.5 |
0.495 |
6 |
9 |
0 |
0.000 |
| 4 |
4 |
|
[APK]B:97 |
30 |
1 |
606 |
cf |
B |
x,y,z |
1_555 |
61 |
20 |
18089 |
384.3 |
0.6 |
0.665 |
12 |
0 |
0 |
0.044 |
5 |
|
[APK]A:97 |
30 |
1 |
600 |
cf |
A |
x,y,z |
1_555 |
60 |
20 |
18335 |
383.1 |
1.1 |
0.659 |
11 |
0 |
0 |
0.044 |
| Average: |
383.7 |
0.8 |
0.662 |
12 |
0 |
0 |
0.044 |
| 5 |
6 |
|
B |
30 |
9 |
18089 |
x |
B |
x-1,y,z |
1_455 |
40 |
15 |
18089 |
344.2 |
-2.0 |
0.422 |
3 |
0 |
0 |
0.000 |
| 6 |
7 |
|
A |
31 |
7 |
18335 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
9 |
18335 |
309.5 |
0.7 |
0.683 |
5 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
29 |
9 |
18089 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
34 |
9 |
18089 |
293.1 |
3.1 |
0.876 |
4 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[SO4]B:502 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
18089 |
97.3 |
-11.7 |
0.950 |
6 |
0 |
0 |
0.074 |
| 9 |
10 |
|
[SO4]A:502 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
18335 |
93.9 |
-11.6 |
0.926 |
4 |
0 |
0 |
0.070 |
| 10 |
11 |
|
[SO4]A:501 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
18335 |
83.2 |
-11.6 |
0.843 |
4 |
0 |
0 |
0.069 |
| 11 |
12 |
|
[SO4]B:501 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
18089 |
81.7 |
-11.5 |
0.836 |
4 |
0 |
0 |
0.069 |
| 12 |
13 |
|
[SO4]A:503 |
5 |
1 |
184 |
f |
A |
x-1,y,z |
1_455 |
12 |
5 |
18335 |
78.2 |
-10.3 |
0.893 |
3 |
0 |
0 |
0.060 |
| 13 |
14 |
|
[SO4]B:503 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
18089 |
77.5 |
-10.0 |
0.871 |
4 |
0 |
0 |
0.061 |
| 14 |
15 |
|
[SO4]A:503 |
5 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
18335 |
67.9 |
-8.9 |
0.754 |
2 |
0 |
0 |
0.000 |
| 15 |
16 |
|
A |
5 |
1 |
18335 |
◊ |
B |
x-1,y,z |
1_455 |
7 |
2 |
18089 |
49.6 |
0.8 |
0.806 |
0 |
2 |
0 |
0.000 |
| 16 |
17 |
|
[SO4]A:502 |
4 |
1 |
184 |
f |
[APK]A:97 |
x,y,z |
1_555 |
8 |
1 |
600 |
42.7 |
-5.0 |
0.748 |
0 |
0 |
0 |
0.026 |
| 17 |
18 |
|
[SO4]B:502 |
4 |
1 |
185 |
f |
[APK]B:97 |
x,y,z |
1_555 |
7 |
1 |
606 |
40.6 |
-4.8 |
0.716 |
0 |
0 |
0 |
0.025 |
| 18 |
19 |
|
[MG]A:504 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
18335 |
39.1 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.044 |
20 |
|
[MG]B:504 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
18089 |
38.9 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.044 |
| Average: |
39.0 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.044 |
| 19 |
21 |
|
[MG]A:504 |
1 |
1 |
98 |
f |
[APK]A:97 |
x,y,z |
1_555 |
6 |
1 |
600 |
38.2 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.054 |
22 |
|
[MG]B:504 |
1 |
1 |
98 |
f |
[APK]B:97 |
x,y,z |
1_555 |
5 |
1 |
606 |
35.8 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.054 |
| Average: |
37.0 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.054 |
| 20 |
23 |
|
A |
4 |
2 |
18335 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
2 |
18089 |
25.5 |
-0.0 |
0.611 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[SO4]B:501 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
18335 |
25.0 |
-3.3 |
0.476 |
0 |
0 |
0 |
0.017 |
| 22 |
25 |
|
[SO4]A:501 |
3 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
18089 |
23.0 |
-3.2 |
0.494 |
0 |
0 |
0 |
0.016 |
| 23 |
26 |
|
[SO4]A:502 |
1 |
1 |
184 |
f |
[SO4]A:501 |
x,y,z |
1_555 |
1 |
1 |
186 |
22.5 |
-5.4 |
0.800 |
0 |
0 |
0 |
0.028 |
| 24 |
27 |
|
[SO4]B:502 |
1 |
1 |
185 |
f |
[SO4]B:501 |
x,y,z |
1_555 |
1 |
1 |
185 |
21.3 |
-5.1 |
0.800 |
0 |
0 |
0 |
0.026 |
| 25 |
28 |
|
[SO4]B:501 |
2 |
1 |
185 |
f |
[APK]B:97 |
x,y,z |
1_555 |
1 |
1 |
606 |
18.4 |
-3.2 |
0.310 |
0 |
0 |
0 |
0.017 |
| 26 |
29 |
|
[SO4]A:501 |
2 |
1 |
186 |
f |
[APK]A:97 |
x,y,z |
1_555 |
2 |
1 |
600 |
18.0 |
-3.1 |
0.422 |
0 |
0 |
0 |
0.016 |
| 27 |
30 |
|
A |
4 |
1 |
18335 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
3 |
2 |
18089 |
14.3 |
-0.1 |
0.587 |
0 |
0 |
0 |
0.000 |
|