## |
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 |
48 |
13 |
8140 |
◊ |
A |
x,y,z |
1_555 |
47 |
13 |
8246 |
424.7 |
-0.9 |
0.548 |
9 |
1 |
0 |
0.000 |
2 |
2 |
|
B |
43 |
11 |
8140 |
◊ |
A |
x-1,y,z |
1_455 |
43 |
11 |
8246 |
344.5 |
-3.2 |
0.333 |
6 |
8 |
0 |
0.000 |
3 |
3 |
|
B |
31 |
9 |
8140 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
27 |
8 |
8140 |
258.9 |
-1.3 |
0.447 |
0 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
26 |
10 |
8246 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
28 |
9 |
8246 |
251.3 |
-2.5 |
0.285 |
3 |
1 |
0 |
0.000 |
5 |
5 |
|
[8WT]B:201 |
12 |
1 |
334 |
f |
B |
x,y,z |
1_555 |
39 |
15 |
8140 |
224.0 |
1.7 |
0.375 |
1 |
0 |
0 |
0.000 |
6 |
|
[8WT]A:201 |
12 |
1 |
331 |
f |
A |
x,y,z |
1_555 |
41 |
15 |
8246 |
216.4 |
1.6 |
0.359 |
2 |
0 |
0 |
0.000 |
Average: |
220.2 |
1.7 |
0.367 |
2 |
0 |
0 |
0.000 |
6 |
7 |
|
B |
10 |
2 |
8140 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
17 |
6 |
8246 |
109.3 |
-0.1 |
0.596 |
1 |
0 |
0 |
0.000 |
7 |
8 |
|
[SO4]A:205 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
22 |
11 |
8246 |
105.6 |
-16.9 |
0.686 |
2 |
0 |
0 |
0.176 |
8 |
9 |
|
[SO4]A:204 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
8246 |
102.1 |
-16.4 |
0.547 |
6 |
0 |
0 |
0.189 |
9 |
10 |
|
[SO4]B:203 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
8140 |
93.7 |
-13.1 |
0.851 |
5 |
0 |
0 |
0.152 |
10 |
11 |
|
B |
11 |
5 |
8140 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
11 |
4 |
8246 |
91.5 |
-0.0 |
0.532 |
0 |
0 |
0 |
0.000 |
11 |
12 |
|
[SO4]A:203 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
8246 |
83.9 |
-11.5 |
0.849 |
4 |
0 |
0 |
0.132 |
12 |
13 |
|
A |
9 |
3 |
8246 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
11 |
4 |
8246 |
79.4 |
0.2 |
0.576 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
[SO4]B:202 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
8140 |
73.3 |
-9.5 |
0.873 |
2 |
0 |
0 |
0.103 |
14 |
15 |
|
[SO4]A:202 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
8246 |
69.2 |
-9.0 |
0.910 |
2 |
0 |
0 |
0.098 |
15 |
16 |
|
B |
9 |
5 |
8140 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
8 |
4 |
8246 |
63.0 |
0.5 |
0.681 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
B |
8 |
3 |
8140 |
◊ |
[SO4]A:203 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
187 |
53.5 |
-7.7 |
0.614 |
1 |
0 |
0 |
0.081 |
17 |
18 |
|
B |
4 |
2 |
8140 |
◊ |
[SO4]A:202 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
188 |
35.6 |
-4.8 |
0.456 |
0 |
0 |
0 |
0.048 |
18 |
19 |
|
[SO4]A:205 |
3 |
1 |
186 |
f |
[8WT]A:201 |
x,y,z |
1_555 |
1 |
1 |
331 |
30.7 |
-2.9 |
0.863 |
1 |
0 |
0 |
0.033 |
19 |
20 |
|
[SO4]B:203 |
1 |
1 |
186 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
4 |
3 |
8246 |
23.7 |
-3.1 |
0.706 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
[SO4]B:202 |
3 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
8246 |
17.1 |
-1.6 |
0.889 |
0 |
0 |
0 |
0.000 |
21 |
22 |
|
A |
4 |
1 |
8246 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
8140 |
16.9 |
0.3 |
0.706 |
0 |
0 |
0 |
0.000 |
22 |
23 |
|
[SO4]A:203 |
2 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
8140 |
16.3 |
-1.6 |
0.894 |
0 |
0 |
0 |
0.000 |
23 |
24 |
|
A |
3 |
2 |
8246 |
◊ |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
4 |
2 |
8140 |
7.2 |
0.1 |
0.659 |
0 |
0 |
0 |
0.000 |
24 |
25 |
|
[SO4]B:203 |
1 |
1 |
186 |
f |
[SO4]B:202 |
x,y,z |
1_555 |
1 |
1 |
186 |
2.9 |
-0.7 |
1.000 |
0 |
0 |
0 |
0.007 |
25 |
26 |
|
[SO4]A:203 |
1 |
1 |
187 |
f |
[SO4]A:202 |
x,y,z |
1_555 |
1 |
1 |
188 |
0.4 |
-0.1 |
1.000 |
0 |
0 |
0 |
0.001 |
|