## |
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 |
397 |
104 |
17794 |
◊ |
A |
x,y,z |
1_555 |
400 |
104 |
17727 |
3798.1 |
-24.4 |
0.200 |
61 |
8 |
0 |
0.209 |
2 |
2 |
|
A |
85 |
24 |
17727 |
◊ |
A |
-x+1,y,-z+1 |
3_656 |
86 |
24 |
17727 |
728.4 |
-5.6 |
0.327 |
4 |
4 |
0 |
0.000 |
3 |
3 |
|
A |
40 |
11 |
17727 |
x |
A |
x-1/2,-y+3/2,-z+3/2 |
8_466 |
48 |
17 |
17727 |
372.4 |
-2.3 |
0.348 |
3 |
0 |
0 |
0.000 |
4 |
4 |
|
B |
34 |
13 |
17794 |
◊ |
A |
x-1/2,-y+3/2,-z+3/2 |
8_466 |
40 |
11 |
17727 |
364.9 |
-2.0 |
0.363 |
4 |
0 |
0 |
0.000 |
5 |
5 |
|
B |
42 |
14 |
17794 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
42 |
14 |
17794 |
363.9 |
-3.0 |
0.371 |
2 |
0 |
0 |
0.000 |
6 |
6 |
|
B |
27 |
7 |
17794 |
◊ |
B |
-x,-y+1,z |
2_565 |
27 |
7 |
17794 |
246.3 |
-0.5 |
0.584 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
[PO4]B:956 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
17794 |
108.0 |
-7.0 |
0.604 |
3 |
0 |
0 |
0.033 |
8 |
8 |
|
[PO4]A:656 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
17727 |
107.9 |
-6.3 |
0.748 |
3 |
0 |
0 |
0.030 |
9 |
9 |
|
[SO4]B:958 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
17794 |
81.1 |
-11.8 |
0.870 |
3 |
0 |
0 |
0.052 |
10 |
10 |
|
[SO4]A:658 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
17727 |
80.1 |
-9.9 |
0.909 |
3 |
0 |
0 |
0.045 |
11 |
11 |
|
B |
6 |
1 |
17794 |
◊ |
[SO4]A:658 |
x-1/2,-y+3/2,-z+3/2 |
8_466 |
4 |
1 |
189 |
57.4 |
-7.0 |
0.873 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
[MG]B:452 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
17794 |
50.1 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.071 |
13 |
|
[MG]A:452 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
17727 |
49.1 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.071 |
Average: |
49.6 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.071 |
13 |
14 |
|
[ZN]A:450 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
17727 |
35.5 |
-24.1 |
0.000 |
0 |
0 |
0 |
0.188 |
15 |
|
[ZN]B:450 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
4 |
17794 |
33.4 |
-23.4 |
0.000 |
0 |
0 |
0 |
0.188 |
Average: |
34.5 |
-23.7 |
0.000 |
0 |
0 |
0 |
0.188 |
14 |
16 |
|
[ZN]A:451 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
17727 |
34.7 |
-27.5 |
0.000 |
0 |
0 |
0 |
0.109 |
15 |
17 |
|
[PO4]B:956 |
3 |
1 |
188 |
f |
[ZN]B:450 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.6 |
-13.3 |
0.000 |
0 |
0 |
0 |
0.104 |
18 |
|
[PO4]A:656 |
3 |
1 |
188 |
f |
[ZN]A:450 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.6 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.104 |
Average: |
28.1 |
-13.1 |
0.000 |
0 |
0 |
0 |
0.104 |
16 |
19 |
|
[PO4]B:956 |
3 |
1 |
188 |
f |
[ZN]B:451 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.0 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.037 |
17 |
20 |
|
[PO4]A:656 |
1 |
1 |
188 |
f |
[ZN]A:451 |
x,y,z |
1_555 |
1 |
1 |
98 |
16.7 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.027 |
18 |
21 |
|
[ZN]B:451 |
1 |
1 |
98 |
f |
[ZN]B:450 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.3 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.036 |
19 |
22 |
|
[ZN]A:451 |
1 |
1 |
98 |
f |
[ZN]A:450 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.6 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.027 |
20 |
23 |
|
[MG]B:452 |
1 |
1 |
98 |
f |
[ZN]B:451 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.1 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.016 |
21 |
24 |
|
[MG]A:452 |
1 |
1 |
98 |
f |
[ZN]A:451 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.4 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.012 |
22 |
25 |
|
[PO4]B:956 |
1 |
1 |
188 |
f |
[MG]B:452 |
x,y,z |
1_555 |
1 |
1 |
98 |
2.7 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.002 |
23 |
26 |
|
[PO4]A:656 |
1 |
1 |
188 |
f |
[MG]A:452 |
x,y,z |
1_555 |
1 |
1 |
98 |
1.8 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.001 |
|