## |
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 |
|
A |
86 |
26 |
9555 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
69 |
17 |
9420 |
719.8 |
-6.7 |
0.171 |
11 |
1 |
0 |
0.000 |
2 |
|
B |
91 |
27 |
9420 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
65 |
17 |
9555 |
690.7 |
-7.0 |
0.192 |
9 |
0 |
0 |
0.000 |
Average: |
705.3 |
-6.9 |
0.181 |
10 |
1 |
0 |
0.000 |
2 |
3 |
|
C |
42 |
7 |
1189 |
◊ |
B |
x,y,z |
1_555 |
64 |
21 |
9420 |
504.2 |
-4.5 |
0.601 |
13 |
2 |
0 |
0.698 |
3 |
4 |
|
B |
42 |
11 |
9420 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
42 |
11 |
9555 |
334.1 |
-4.7 |
0.296 |
0 |
0 |
0 |
0.000 |
4 |
5 |
|
B |
26 |
10 |
9420 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
38 |
12 |
9555 |
319.6 |
0.4 |
0.593 |
3 |
3 |
0 |
0.000 |
5 |
6 |
|
B |
25 |
12 |
9420 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
29 |
13 |
9555 |
282.9 |
2.0 |
0.846 |
6 |
2 |
0 |
0.000 |
6 |
7 |
|
C |
30 |
7 |
1189 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
29 |
8 |
9420 |
273.9 |
-1.1 |
0.738 |
4 |
0 |
0 |
0.000 |
7 |
8 |
|
C |
23 |
4 |
1189 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
35 |
12 |
9555 |
232.7 |
-0.4 |
0.757 |
1 |
1 |
0 |
0.000 |
8 |
9 |
|
B |
24 |
8 |
9420 |
◊ |
A |
x,y,z |
1_555 |
23 |
7 |
9555 |
230.9 |
-1.9 |
0.423 |
2 |
0 |
0 |
0.000 |
9 |
10 |
|
A |
28 |
10 |
9555 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
23 |
8 |
9555 |
209.7 |
0.3 |
0.689 |
0 |
0 |
0 |
0.000 |
11 |
|
B |
15 |
5 |
9420 |
x |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
14 |
5 |
9420 |
147.3 |
1.2 |
0.786 |
1 |
0 |
0 |
0.000 |
Average: |
178.5 |
0.7 |
0.737 |
1 |
0 |
0 |
0.000 |
10 |
12 |
|
B |
18 |
5 |
9420 |
◊ |
A |
x,y,z-1 |
1_554 |
21 |
6 |
9555 |
160.2 |
1.6 |
0.727 |
2 |
2 |
0 |
0.000 |
11 |
13 |
|
B |
22 |
4 |
9420 |
◊ |
[MES]A:1 |
-x+1/2,-y,z-1/2 |
2_554 |
11 |
1 |
338 |
135.4 |
4.7 |
0.171 |
0 |
0 |
0 |
0.000 |
12 |
14 |
|
[MES]A:1 |
11 |
1 |
338 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
13 |
5 |
9555 |
122.9 |
1.5 |
0.029 |
0 |
0 |
0 |
0.000 |
13 |
15 |
|
[SO4]A:1183 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
11 |
9555 |
103.2 |
-16.3 |
0.693 |
4 |
0 |
0 |
0.047 |
14 |
16 |
|
[SO4]A:2 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
9555 |
84.2 |
-10.9 |
0.871 |
3 |
0 |
0 |
0.032 |
15 |
17 |
|
[ACE]C:0 |
3 |
1 |
171 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
16 |
5 |
9555 |
70.9 |
-0.9 |
0.721 |
0 |
0 |
0 |
0.000 |
16 |
18 |
|
[SO4]A:2 |
5 |
1 |
185 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
7 |
4 |
9555 |
59.1 |
-7.8 |
0.796 |
2 |
0 |
0 |
0.000 |
17 |
19 |
|
[SO4]A:3 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
9555 |
57.6 |
-7.9 |
0.744 |
1 |
0 |
0 |
0.022 |
18 |
20 |
|
[MES]A:1 |
5 |
1 |
338 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
9555 |
57.5 |
0.4 |
0.066 |
0 |
0 |
0 |
0.000 |
19 |
21 |
|
[ACE]C:0 |
3 |
1 |
171 |
cf |
C |
x,y,z |
1_555 |
7 |
2 |
1189 |
50.5 |
0.0 |
0.837 |
1 |
0 |
0 |
0.100 |
20 |
22 |
|
[SO4]A:1183 |
4 |
1 |
184 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
1 |
9555 |
37.4 |
-3.8 |
0.937 |
1 |
0 |
0 |
0.000 |
21 |
23 |
|
[ACE]C:0 |
3 |
1 |
171 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
9420 |
35.9 |
-0.2 |
0.755 |
0 |
0 |
0 |
0.013 |
22 |
24 |
|
B |
3 |
1 |
9420 |
◊ |
[SO4]A:3 |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
1 |
186 |
33.2 |
-2.7 |
0.957 |
1 |
0 |
0 |
0.000 |
23 |
25 |
|
B |
3 |
2 |
9420 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
9420 |
16.3 |
-0.3 |
0.267 |
0 |
0 |
0 |
0.000 |
24 |
26 |
|
C |
2 |
1 |
1189 |
◊ |
[SO4]A:3 |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
1 |
186 |
14.1 |
-2.1 |
0.663 |
0 |
0 |
0 |
0.000 |
25 |
27 |
|
B |
1 |
1 |
9420 |
f |
[ZN]A:1184 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
98 |
10.2 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.262 |
26 |
28 |
|
A |
2 |
2 |
9555 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
3 |
2 |
9420 |
7.8 |
0.2 |
0.666 |
0 |
0 |
0 |
0.000 |
27 |
29 |
|
A |
2 |
1 |
9555 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
9555 |
5.5 |
0.1 |
0.727 |
0 |
0 |
0 |
0.000 |
|