## |
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 |
126 |
31 |
11552 |
◊ |
A |
x,y,z |
1_555 |
118 |
28 |
11232 |
1076.2 |
-10.5 |
0.214 |
6 |
10 |
0 |
0.151 |
2 |
2 |
|
A |
109 |
27 |
11232 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
101 |
23 |
11552 |
979.4 |
-11.2 |
0.141 |
3 |
0 |
0 |
0.109 |
3 |
3 |
|
A |
29 |
9 |
11232 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
28 |
11 |
11552 |
259.9 |
-1.2 |
0.494 |
2 |
4 |
0 |
0.000 |
4 |
|
A |
30 |
11 |
11232 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
30 |
10 |
11552 |
258.1 |
-1.4 |
0.500 |
2 |
2 |
0 |
0.000 |
Average: |
259.0 |
-1.3 |
0.497 |
2 |
3 |
0 |
0.000 |
4 |
5 |
|
B |
19 |
8 |
11552 |
◊ |
A |
x,y,z-1 |
1_554 |
10 |
3 |
11232 |
135.7 |
1.4 |
0.772 |
4 |
0 |
0 |
0.000 |
6 |
|
A |
17 |
8 |
11232 |
◊ |
B |
x-1,y,z |
1_455 |
11 |
3 |
11552 |
133.6 |
1.5 |
0.780 |
2 |
0 |
0 |
0.000 |
Average: |
134.7 |
1.4 |
0.776 |
3 |
0 |
0 |
0.000 |
5 |
7 |
|
[BME]A:1209 |
4 |
1 |
209 |
f |
A |
x,y,z |
1_555 |
29 |
9 |
11232 |
129.3 |
-1.2 |
0.375 |
0 |
0 |
0 |
0.012 |
6 |
8 |
|
[SO4]A:1206 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
11232 |
100.2 |
-15.1 |
0.660 |
4 |
0 |
0 |
0.174 |
7 |
9 |
|
[SO4]B:1206 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
11552 |
99.9 |
-17.5 |
0.632 |
4 |
0 |
0 |
0.199 |
8 |
10 |
|
[BME]A:1208 |
4 |
1 |
210 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
11232 |
88.7 |
1.0 |
0.629 |
1 |
0 |
0 |
0.000 |
9 |
11 |
|
[SO4]B:1207 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
11552 |
85.9 |
-11.3 |
0.894 |
4 |
0 |
0 |
0.135 |
10 |
12 |
|
[SO4]B:1208 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
11552 |
85.7 |
-11.4 |
0.359 |
0 |
0 |
0 |
0.118 |
11 |
13 |
|
[SO4]A:1207 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
11232 |
79.1 |
-8.6 |
0.959 |
5 |
0 |
0 |
0.112 |
12 |
14 |
|
[BME]A:1208 |
4 |
1 |
210 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
11552 |
75.9 |
0.2 |
0.535 |
0 |
0 |
0 |
0.000 |
13 |
15 |
|
A |
8 |
4 |
11232 |
◊ |
[SO4]B:1208 |
-x+1,y-1/2,-z+1 |
2_646 |
5 |
1 |
184 |
70.6 |
-10.5 |
0.653 |
1 |
0 |
0 |
0.095 |
14 |
16 |
|
A |
4 |
1 |
11232 |
◊ |
[SO4]B:1207 |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
186 |
41.2 |
-4.8 |
0.702 |
1 |
0 |
0 |
0.045 |
15 |
17 |
|
[SO4]A:1207 |
4 |
1 |
185 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
11552 |
39.0 |
-4.6 |
0.700 |
0 |
0 |
0 |
0.040 |
16 |
18 |
|
[BME]A:1209 |
4 |
1 |
209 |
f |
[SO4]A:1206 |
x,y,z |
1_555 |
4 |
1 |
185 |
36.9 |
-2.8 |
0.747 |
0 |
0 |
0 |
0.029 |
17 |
19 |
|
A |
4 |
2 |
11232 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
1 |
11232 |
32.7 |
0.5 |
0.779 |
0 |
0 |
0 |
0.000 |
20 |
|
B |
1 |
1 |
11552 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
11552 |
6.4 |
0.3 |
0.810 |
0 |
0 |
0 |
0.000 |
Average: |
19.5 |
0.4 |
0.795 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[SO4]A:1207 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
11552 |
20.8 |
-2.7 |
0.690 |
0 |
0 |
0 |
0.028 |
19 |
22 |
|
A |
1 |
1 |
11232 |
◊ |
[SO4]B:1206 |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
1 |
185 |
18.2 |
-1.7 |
0.937 |
0 |
0 |
0 |
0.015 |
20 |
23 |
|
[SO4]A:1206 |
3 |
1 |
185 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
2 |
11552 |
16.4 |
-1.5 |
0.900 |
0 |
0 |
0 |
0.013 |
21 |
24 |
|
B |
1 |
1 |
11552 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
2 |
1 |
11552 |
10.9 |
-0.0 |
0.582 |
0 |
0 |
0 |
0.000 |
25 |
|
A |
2 |
1 |
11232 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
11232 |
9.3 |
0.0 |
0.642 |
0 |
0 |
0 |
0.000 |
Average: |
10.1 |
0.0 |
0.612 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[SO4]B:1208 |
2 |
1 |
184 |
f |
[SO4]B:1206 |
x,y,z |
1_555 |
2 |
1 |
185 |
9.4 |
-2.3 |
0.960 |
0 |
0 |
0 |
0.023 |
23 |
27 |
|
[SO4]B:1207 |
2 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
11232 |
8.8 |
-1.1 |
0.777 |
0 |
0 |
0 |
0.011 |
24 |
28 |
|
[BME]A:1209 |
2 |
1 |
209 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
11552 |
6.9 |
0.3 |
0.604 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
[SO4]B:1207 |
1 |
1 |
186 |
f |
[SO4]B:1206 |
x,y,z |
1_555 |
1 |
1 |
185 |
5.8 |
-1.4 |
0.800 |
0 |
0 |
0 |
0.014 |
26 |
30 |
|
[BME]A:1209 |
1 |
1 |
209 |
f |
[SO4]A:1207 |
x,y,z |
1_555 |
1 |
1 |
185 |
0.4 |
-0.0 |
0.500 |
0 |
0 |
0 |
0.000 |
|