## |
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 |
326 |
91 |
17355 |
◊ |
A |
x,y,z |
1_555 |
324 |
89 |
17729 |
3242.5 |
-24.3 |
0.073 |
43 |
19 |
0 |
0.230 |
2 |
2 |
|
A |
69 |
21 |
17729 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
76 |
24 |
17355 |
715.9 |
3.6 |
0.851 |
15 |
3 |
0 |
0.000 |
3 |
3 |
|
B |
53 |
16 |
17355 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
56 |
17 |
17355 |
533.5 |
4.9 |
0.906 |
11 |
10 |
0 |
0.000 |
4 |
4 |
|
[EM2]B:401 |
16 |
1 |
415 |
cf |
B |
x,y,z |
1_555 |
39 |
16 |
17355 |
275.3 |
4.5 |
0.693 |
8 |
0 |
0 |
0.000 |
5 |
|
[EM2]A:401 |
16 |
1 |
412 |
cf |
A |
x,y,z |
1_555 |
39 |
16 |
17729 |
267.9 |
3.3 |
0.690 |
8 |
0 |
0 |
0.000 |
Average: |
271.6 |
3.9 |
0.692 |
8 |
0 |
0 |
0.000 |
5 |
6 |
|
A |
32 |
9 |
17729 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
24 |
10 |
17729 |
233.6 |
0.1 |
0.597 |
2 |
2 |
0 |
0.000 |
6 |
7 |
|
[SO4]A:404 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
17729 |
111.3 |
-16.0 |
0.684 |
3 |
0 |
0 |
0.086 |
7 |
8 |
|
[SO4]B:402 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
17355 |
109.9 |
-15.9 |
0.690 |
5 |
0 |
0 |
0.090 |
8 |
9 |
|
[SO4]A:403 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
17729 |
104.8 |
-13.7 |
0.915 |
4 |
0 |
0 |
0.077 |
9 |
10 |
|
[SO4]A:405 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
20 |
5 |
17729 |
91.2 |
-12.2 |
0.796 |
2 |
0 |
0 |
0.065 |
10 |
11 |
|
[SO4]B:403 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
17355 |
89.5 |
-14.1 |
0.794 |
4 |
0 |
0 |
0.079 |
11 |
12 |
|
B |
12 |
6 |
17355 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
17 |
6 |
17729 |
85.8 |
-0.7 |
0.461 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
[SO4]A:402 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
17729 |
81.9 |
-11.5 |
0.769 |
4 |
0 |
0 |
0.066 |
13 |
14 |
|
A |
16 |
5 |
17729 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
4 |
17355 |
78.9 |
1.2 |
0.764 |
1 |
2 |
0 |
0.000 |
14 |
15 |
|
A |
11 |
4 |
17729 |
◊ |
[SO4]A:402 |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
1 |
185 |
67.0 |
-9.0 |
0.850 |
5 |
0 |
0 |
0.000 |
15 |
16 |
|
[CL]B:405 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
17355 |
66.7 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.096 |
17 |
|
[CL]A:409 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
17729 |
66.7 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.096 |
Average: |
66.7 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.096 |
16 |
18 |
|
[NA]A:406 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
17729 |
64.1 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.096 |
19 |
|
[NA]B:404 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
17355 |
63.8 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.096 |
Average: |
64.0 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.096 |
17 |
20 |
|
[NA]A:407 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
17729 |
63.9 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.061 |
18 |
21 |
|
[EM2]B:401 |
6 |
1 |
415 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
17729 |
54.7 |
1.0 |
0.621 |
0 |
0 |
0 |
0.000 |
22 |
|
[EM2]A:401 |
6 |
1 |
412 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
17355 |
54.4 |
0.9 |
0.587 |
0 |
0 |
0 |
0.000 |
Average: |
54.6 |
1.0 |
0.604 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
A |
6 |
2 |
17729 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
8 |
4 |
17355 |
48.1 |
0.7 |
0.746 |
1 |
1 |
0 |
0.000 |
20 |
24 |
|
[NA]A:408 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
17729 |
47.8 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.032 |
21 |
25 |
|
[NA]A:408 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
17355 |
46.9 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.031 |
22 |
26 |
|
B |
4 |
2 |
17355 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
5 |
3 |
17729 |
41.2 |
0.5 |
0.676 |
0 |
0 |
0 |
0.000 |
23 |
27 |
|
[SO4]A:405 |
1 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
17355 |
6.3 |
-0.7 |
0.795 |
0 |
0 |
0 |
0.003 |
|