## |
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 |
89 |
28 |
16502 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
90 |
24 |
16639 |
847.2 |
-0.6 |
0.503 |
8 |
6 |
0 |
0.033 |
2 |
2 |
|
B |
76 |
22 |
16502 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
91 |
27 |
16639 |
727.9 |
-3.1 |
0.276 |
12 |
3 |
0 |
0.058 |
3 |
3 |
|
B |
58 |
18 |
16502 |
◊ |
A |
x,y,z |
1_555 |
51 |
15 |
16639 |
475.8 |
0.6 |
0.584 |
7 |
2 |
0 |
0.000 |
4 |
4 |
|
B |
46 |
14 |
16502 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
49 |
19 |
16639 |
418.3 |
1.9 |
0.679 |
2 |
2 |
0 |
0.000 |
5 |
5 |
|
A |
29 |
8 |
16639 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
27 |
8 |
16639 |
221.2 |
1.5 |
0.704 |
3 |
1 |
0 |
0.000 |
6 |
6 |
|
B |
25 |
10 |
16502 |
◊ |
A |
x,y-1,z |
1_545 |
23 |
9 |
16639 |
172.0 |
-2.1 |
0.231 |
1 |
0 |
0 |
0.000 |
7 |
7 |
|
B |
17 |
5 |
16502 |
x |
B |
-x,y-1/2,-z+1/2 |
3_545 |
11 |
4 |
16502 |
104.7 |
-0.3 |
0.503 |
1 |
0 |
0 |
0.000 |
8 |
8 |
|
[SO4]A:402 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
23 |
15 |
16639 |
103.3 |
-15.1 |
0.622 |
0 |
0 |
0 |
0.098 |
9 |
9 |
|
[SO4]B:402 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
21 |
14 |
16502 |
102.7 |
-15.1 |
0.638 |
0 |
0 |
0 |
0.098 |
10 |
10 |
|
[SO4]A:401 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
21 |
12 |
16639 |
100.8 |
-15.1 |
0.659 |
5 |
0 |
0 |
0.226 |
11 |
|
[SO4]B:401 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
21 |
12 |
16502 |
98.9 |
-15.0 |
0.672 |
5 |
0 |
0 |
0.226 |
Average: |
99.8 |
-15.1 |
0.665 |
5 |
0 |
0 |
0.226 |
11 |
12 |
|
[SO4]B:403 |
5 |
1 |
186 |
f |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
15 |
5 |
16639 |
83.4 |
-9.5 |
0.912 |
3 |
0 |
0 |
0.070 |
12 |
13 |
|
A |
10 |
4 |
16639 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
14 |
5 |
16502 |
83.3 |
0.2 |
0.591 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
[SO4]B:403 |
5 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
16502 |
69.3 |
-9.4 |
0.875 |
3 |
0 |
0 |
0.070 |
14 |
15 |
|
B |
8 |
3 |
16502 |
f |
[SO4]A:404 |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
1 |
186 |
67.4 |
-8.0 |
0.769 |
2 |
0 |
0 |
0.058 |
15 |
16 |
|
[SO4]A:403 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
16639 |
67.0 |
-8.5 |
0.918 |
3 |
0 |
0 |
0.064 |
16 |
17 |
|
[SO4]A:403 |
5 |
1 |
187 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
8 |
3 |
16639 |
61.7 |
-7.8 |
0.873 |
3 |
0 |
0 |
0.000 |
17 |
18 |
|
[SO4]A:404 |
5 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
16639 |
51.5 |
-6.2 |
0.870 |
2 |
0 |
0 |
0.046 |
18 |
19 |
|
[MG]B:404 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
16502 |
47.7 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.086 |
20 |
|
[MG]A:405 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
16639 |
46.9 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.086 |
Average: |
47.3 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.086 |
19 |
21 |
|
[SO4]B:402 |
4 |
1 |
187 |
f |
[SO4]B:401 |
x,y,z |
1_555 |
4 |
1 |
188 |
39.6 |
-8.8 |
0.998 |
0 |
0 |
0 |
0.057 |
20 |
22 |
|
[SO4]A:402 |
4 |
1 |
187 |
f |
[SO4]A:401 |
x,y,z |
1_555 |
4 |
1 |
188 |
38.7 |
-8.6 |
0.998 |
0 |
0 |
0 |
0.056 |
21 |
23 |
|
[MG]A:405 |
1 |
1 |
98 |
f |
[SO4]A:401 |
x,y,z |
1_555 |
4 |
1 |
188 |
16.0 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.039 |
24 |
|
[MG]B:404 |
1 |
1 |
98 |
f |
[SO4]B:401 |
x,y,z |
1_555 |
4 |
1 |
188 |
14.1 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.039 |
Average: |
15.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.039 |
22 |
25 |
|
[MG]B:404 |
1 |
1 |
98 |
f |
[SO4]B:402 |
x,y,z |
1_555 |
1 |
1 |
187 |
14.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.021 |
23 |
26 |
|
[MG]A:405 |
1 |
1 |
98 |
f |
[SO4]A:402 |
x,y,z |
1_555 |
1 |
1 |
187 |
14.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.021 |
24 |
27 |
|
A |
1 |
1 |
16639 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
16502 |
2.9 |
0.2 |
0.787 |
0 |
0 |
0 |
0.000 |
|