## |
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 |
404 |
104 |
17801 |
◊ |
A |
x,y,z |
1_555 |
403 |
105 |
17783 |
3844.9 |
-22.1 |
0.314 |
60 |
5 |
0 |
0.196 |
2 |
2 |
|
B |
60 |
18 |
17801 |
◊ |
B |
-y+1,-x+1,-z+1/2 |
8_665 |
61 |
19 |
17801 |
588.3 |
-0.1 |
0.710 |
8 |
2 |
0 |
0.000 |
3 |
3 |
|
A |
61 |
22 |
17783 |
◊ |
A |
x,x-y,-z+1/2 |
12_555 |
59 |
22 |
17783 |
558.7 |
1.5 |
0.808 |
6 |
6 |
0 |
0.000 |
4 |
|
B |
59 |
23 |
17801 |
◊ |
B |
y,x,-z+1 |
11_556 |
60 |
23 |
17801 |
525.4 |
1.6 |
0.813 |
8 |
4 |
0 |
0.000 |
Average: |
542.1 |
1.5 |
0.811 |
7 |
5 |
0 |
0.000 |
4 |
5 |
|
B |
33 |
9 |
17801 |
◊ |
A |
x,x-y,-z+1/2 |
12_555 |
35 |
12 |
17783 |
309.5 |
2.2 |
0.848 |
4 |
2 |
0 |
0.000 |
6 |
|
B |
31 |
12 |
17801 |
◊ |
A |
y,x,-z+1 |
11_556 |
33 |
9 |
17783 |
304.6 |
2.3 |
0.841 |
3 |
1 |
0 |
0.000 |
Average: |
307.0 |
2.3 |
0.844 |
4 |
2 |
0 |
0.000 |
5 |
7 |
|
A |
29 |
12 |
17783 |
◊ |
B |
-y+1,x-y,z |
3_655 |
30 |
7 |
17801 |
246.7 |
2.6 |
0.874 |
8 |
5 |
0 |
0.000 |
6 |
8 |
|
B |
15 |
4 |
17801 |
◊ |
A |
x-y,x,z-1/2 |
2_554 |
15 |
3 |
17783 |
127.1 |
-0.3 |
0.589 |
0 |
0 |
0 |
0.000 |
7 |
9 |
|
A |
18 |
5 |
17783 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
17 |
5 |
17783 |
112.5 |
-0.8 |
0.518 |
0 |
0 |
0 |
0.000 |
8 |
10 |
|
A |
16 |
7 |
17783 |
x |
A |
-y+1,x-y,z |
3_655 |
16 |
6 |
17783 |
111.0 |
-0.1 |
0.501 |
1 |
0 |
0 |
0.000 |
9 |
11 |
|
[PO4]B:453 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
17801 |
100.2 |
-7.6 |
0.341 |
5 |
0 |
0 |
0.076 |
12 |
|
[PO4]A:453 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
21 |
12 |
17783 |
100.0 |
-7.1 |
0.557 |
5 |
0 |
0 |
0.076 |
Average: |
100.1 |
-7.4 |
0.449 |
5 |
0 |
0 |
0.076 |
10 |
13 |
|
[MG]A:452 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
17783 |
48.8 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.069 |
14 |
|
[MG]B:452 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
8 |
17801 |
47.7 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.069 |
Average: |
48.3 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.069 |
11 |
15 |
|
[ZN]A:450 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
6 |
4 |
17783 |
36.1 |
-25.5 |
0.000 |
0 |
0 |
0 |
0.196 |
16 |
|
[ZN]B:450 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
7 |
5 |
17801 |
35.6 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.196 |
Average: |
35.9 |
-24.7 |
0.000 |
0 |
0 |
0 |
0.196 |
12 |
17 |
|
[ZN]B:451 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
7 |
5 |
17801 |
34.4 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.210 |
18 |
|
[ZN]A:451 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
17783 |
33.8 |
-26.8 |
0.000 |
0 |
0 |
0 |
0.210 |
Average: |
34.1 |
-26.5 |
0.000 |
0 |
0 |
0 |
0.210 |
13 |
19 |
|
B |
3 |
2 |
17801 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
2 |
1 |
17783 |
28.0 |
1.7 |
0.955 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
[PO4]B:453 |
4 |
1 |
186 |
f |
[ZN]B:450 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.9 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.100 |
21 |
|
[PO4]A:453 |
4 |
1 |
188 |
f |
[ZN]A:450 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.6 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.100 |
Average: |
25.7 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.100 |
15 |
22 |
|
[PO4]A:453 |
3 |
1 |
188 |
f |
[ZN]A:451 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.1 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.080 |
23 |
|
[PO4]B:453 |
3 |
1 |
186 |
f |
[ZN]B:451 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.9 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.080 |
Average: |
23.0 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.080 |
16 |
24 |
|
[PO4]A:453 |
1 |
1 |
188 |
f |
[MG]A:452 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.011 |
25 |
|
[PO4]B:453 |
1 |
1 |
186 |
f |
[MG]B:452 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.5 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.011 |
Average: |
8.5 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.011 |
17 |
26 |
|
[ZN]B:451 |
1 |
1 |
98 |
f |
[ZN]B:450 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.9 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.025 |
18 |
27 |
|
[ZN]A:451 |
1 |
1 |
98 |
f |
[ZN]A:450 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.9 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.022 |
19 |
28 |
|
[MG]A:452 |
1 |
1 |
98 |
f |
[ZN]A:451 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.3 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.008 |
20 |
29 |
|
[MG]B:452 |
1 |
1 |
98 |
f |
[ZN]B:451 |
x,y,z |
1_555 |
1 |
1 |
98 |
3.8 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.007 |
|