## |
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 |
99 |
29 |
7876 |
◊ |
A |
x,y,z |
1_555 |
97 |
29 |
7757 |
894.8 |
-9.3 |
0.329 |
12 |
4 |
0 |
0.515 |
2 |
2 |
|
A |
36 |
14 |
7757 |
◊ |
A |
-x+5/4,-z+5/4,-y+5/4 |
19_666 |
37 |
14 |
7757 |
312.3 |
-4.4 |
0.311 |
0 |
0 |
0 |
0.000 |
3 |
3 |
|
B |
33 |
11 |
7876 |
x |
B |
z+1/4,y-1/4,-x+3/4 |
21_545 |
36 |
11 |
7876 |
309.3 |
-5.5 |
0.169 |
1 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
26 |
8 |
7757 |
x |
A |
z+1/4,y-1/4,-x+3/4 |
21_545 |
25 |
9 |
7757 |
261.2 |
-4.0 |
0.214 |
0 |
0 |
0 |
0.000 |
5 |
5 |
|
A |
24 |
7 |
7757 |
◊ |
B |
z+1/4,y-1/4,-x+3/4 |
21_545 |
24 |
7 |
7876 |
211.4 |
-1.3 |
0.535 |
4 |
1 |
0 |
0.000 |
6 |
6 |
|
B |
24 |
9 |
7876 |
x |
B |
-z+1/2,-x+1,y-1/2 |
7_564 |
27 |
6 |
7876 |
208.1 |
-1.9 |
0.451 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
[EDO]B:148 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
17 |
6 |
7876 |
105.8 |
2.7 |
0.448 |
1 |
0 |
0 |
0.000 |
8 |
8 |
|
[EDO]A:150 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
7757 |
104.2 |
3.3 |
0.523 |
2 |
0 |
0 |
0.000 |
9 |
9 |
|
B |
11 |
3 |
7876 |
◊ |
A |
z+1/4,y-1/4,-x+3/4 |
21_545 |
10 |
2 |
7757 |
102.5 |
0.2 |
0.646 |
1 |
0 |
0 |
0.000 |
10 |
10 |
|
[EDO]B:146 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
7876 |
101.3 |
3.4 |
0.518 |
2 |
0 |
0 |
0.000 |
11 |
11 |
|
[SO4]A:146 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
7757 |
93.9 |
-13.0 |
0.775 |
3 |
0 |
0 |
0.482 |
12 |
12 |
|
[EDO]A:147 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
15 |
7 |
7757 |
92.9 |
2.8 |
0.308 |
5 |
0 |
0 |
0.000 |
13 |
|
[EDO]B:145 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
13 |
7 |
7876 |
92.9 |
2.8 |
0.308 |
3 |
0 |
0 |
0.000 |
Average: |
92.9 |
2.8 |
0.308 |
4 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]A:151 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
7757 |
83.0 |
2.6 |
0.492 |
1 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]A:148 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
7757 |
80.3 |
2.9 |
0.493 |
0 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]B:147 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
7876 |
80.2 |
2.8 |
0.494 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]A:152 |
4 |
1 |
186 |
◊ |
B |
z+1/4,y-1/4,-x+3/4 |
21_545 |
9 |
4 |
7876 |
79.5 |
2.7 |
0.475 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
[SO4]A:145 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
7757 |
78.4 |
-11.2 |
0.696 |
2 |
0 |
0 |
0.407 |
18 |
19 |
|
[EDO]A:149 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
7757 |
69.1 |
2.0 |
0.232 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
[EDO]A:152 |
3 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
7757 |
41.9 |
1.6 |
0.936 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
[EDO]A:152 |
3 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
7876 |
41.3 |
1.0 |
0.925 |
1 |
0 |
0 |
0.000 |
21 |
22 |
|
[SO4]A:145 |
4 |
1 |
185 |
◊ |
B |
z+1/4,y-1/4,-x+3/4 |
21_545 |
6 |
3 |
7876 |
41.3 |
-5.1 |
0.703 |
0 |
0 |
0 |
0.000 |
22 |
23 |
|
[EDO]B:148 |
2 |
1 |
185 |
f |
[EDO]B:146 |
x,y,z |
1_555 |
2 |
1 |
183 |
40.2 |
2.1 |
0.707 |
0 |
0 |
0 |
0.000 |
23 |
24 |
|
[EDO]A:149 |
2 |
1 |
185 |
◊ |
B |
z+1/4,y-1/4,-x+3/4 |
21_545 |
4 |
3 |
7876 |
37.5 |
1.2 |
0.905 |
0 |
0 |
0 |
0.000 |
24 |
25 |
|
[EDO]A:149 |
4 |
1 |
185 |
◊ |
A |
z+1/4,y-1/4,-x+3/4 |
21_545 |
2 |
1 |
7757 |
34.4 |
0.5 |
0.828 |
0 |
0 |
0 |
0.000 |
25 |
26 |
|
[EDO]A:149 |
3 |
1 |
185 |
f |
[SO4]A:145 |
x,y,z |
1_555 |
3 |
1 |
185 |
31.3 |
-2.6 |
0.996 |
0 |
0 |
0 |
0.088 |
26 |
27 |
|
A |
1 |
1 |
7757 |
f |
[EDO]A:147 |
z+1/4,y-1/4,-x+3/4 |
21_545 |
3 |
1 |
184 |
23.1 |
0.4 |
0.294 |
0 |
0 |
0 |
0.000 |
27 |
28 |
|
[SO4]A:146 |
3 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
7876 |
20.2 |
-2.0 |
0.908 |
0 |
0 |
0 |
0.066 |
28 |
29 |
|
B |
7 |
3 |
7876 |
◊ |
B |
-x+3/4,z+1/4,y-1/4 |
18_554 |
6 |
3 |
7876 |
19.7 |
-0.3 |
0.532 |
0 |
0 |
0 |
0.000 |
29 |
30 |
|
[EDO]A:148 |
1 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
7876 |
17.3 |
0.3 |
0.844 |
0 |
0 |
0 |
0.000 |
30 |
31 |
|
[EDO]A:148 |
2 |
1 |
184 |
f |
[SO4]A:146 |
x,y,z |
1_555 |
3 |
1 |
187 |
9.5 |
-0.9 |
0.996 |
0 |
0 |
0 |
0.029 |
31 |
32 |
|
[EDO]B:145 |
1 |
1 |
184 |
f |
B |
z+1/4,y-1/4,-x+3/4 |
21_545 |
1 |
1 |
7876 |
4.5 |
0.1 |
0.597 |
0 |
0 |
0 |
0.000 |
32 |
33 |
|
B |
1 |
1 |
7876 |
f |
[EDO]B:146 |
-z+1/2,-x+1,y-1/2 |
7_564 |
1 |
1 |
183 |
0.5 |
0.0 |
0.825 |
0 |
0 |
0 |
0.000 |
|