## |
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 |
119 |
34 |
20975 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
116 |
32 |
20713 |
1213.4 |
-11.0 |
0.135 |
15 |
11 |
0 |
0.080 |
2 |
2 |
|
[O1Q]B:603 |
30 |
1 |
643 |
f |
B |
x,y,z |
1_555 |
70 |
26 |
20713 |
452.0 |
-6.8 |
0.375 |
2 |
0 |
0 |
0.063 |
3 |
|
[O1Q]A:603 |
31 |
1 |
643 |
f |
A |
x,y,z |
1_555 |
72 |
25 |
20975 |
448.4 |
-6.7 |
0.414 |
2 |
0 |
0 |
0.063 |
Average: |
450.2 |
-6.8 |
0.394 |
2 |
0 |
0 |
0.063 |
3 |
4 |
|
A |
48 |
15 |
20975 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
44 |
13 |
20713 |
449.2 |
6.6 |
0.959 |
10 |
3 |
0 |
0.000 |
4 |
5 |
|
A |
37 |
12 |
20975 |
◊ |
A |
-x,-y,z |
2_555 |
37 |
12 |
20975 |
402.1 |
0.2 |
0.656 |
8 |
6 |
0 |
0.000 |
5 |
6 |
|
A |
39 |
12 |
20975 |
◊ |
B |
-x+1,-y,z-1 |
2_654 |
36 |
10 |
20713 |
331.9 |
0.3 |
0.642 |
5 |
0 |
0 |
0.000 |
7 |
|
B |
35 |
13 |
20713 |
◊ |
A |
-x+1,-y,z |
2_655 |
40 |
10 |
20975 |
329.2 |
-2.2 |
0.381 |
4 |
0 |
0 |
0.000 |
Average: |
330.6 |
-0.9 |
0.511 |
5 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
30 |
9 |
20713 |
◊ |
A |
x,y,z |
1_555 |
30 |
11 |
20975 |
235.9 |
-2.4 |
0.314 |
1 |
0 |
0 |
0.000 |
7 |
9 |
|
A |
17 |
5 |
20975 |
x |
A |
x,y,z-1 |
1_554 |
14 |
4 |
20975 |
108.2 |
-1.0 |
0.399 |
0 |
0 |
0 |
0.000 |
10 |
|
B |
12 |
5 |
20713 |
x |
B |
x,y,z-1 |
1_554 |
8 |
2 |
20713 |
72.1 |
-1.1 |
0.361 |
0 |
0 |
0 |
0.000 |
Average: |
90.2 |
-1.0 |
0.380 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
[PO4]A:605 |
5 |
1 |
192 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
20975 |
90.2 |
-6.1 |
0.610 |
8 |
0 |
0 |
0.080 |
12 |
|
[PO4]B:605 |
5 |
1 |
192 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
20713 |
90.1 |
-6.2 |
0.607 |
8 |
0 |
0 |
0.080 |
Average: |
90.2 |
-6.1 |
0.609 |
8 |
0 |
0 |
0.080 |
9 |
13 |
|
B |
9 |
4 |
20713 |
◊ |
B |
-x+1,-y,z |
2_655 |
8 |
4 |
20713 |
67.5 |
0.1 |
0.651 |
0 |
0 |
0 |
0.000 |
10 |
14 |
|
[CA]B:604 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
20713 |
47.6 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.096 |
15 |
|
[CA]A:604 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
20975 |
47.3 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.096 |
Average: |
47.4 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.096 |
11 |
16 |
|
[PO4]A:605 |
4 |
1 |
192 |
f |
[O1Q]A:603 |
x,y,z |
1_555 |
4 |
1 |
643 |
37.1 |
-2.1 |
0.540 |
0 |
0 |
0 |
0.017 |
17 |
|
[PO4]B:605 |
4 |
1 |
192 |
f |
[O1Q]B:603 |
x,y,z |
1_555 |
5 |
1 |
643 |
37.0 |
-2.1 |
0.556 |
0 |
0 |
0 |
0.017 |
Average: |
37.1 |
-2.1 |
0.548 |
0 |
0 |
0 |
0.017 |
12 |
18 |
|
[ZN]A:601 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
20975 |
36.0 |
-23.3 |
0.000 |
0 |
0 |
0 |
0.193 |
19 |
|
[ZN]B:601 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
20713 |
35.3 |
-23.3 |
0.000 |
0 |
0 |
0 |
0.193 |
Average: |
35.6 |
-23.3 |
0.000 |
0 |
0 |
0 |
0.193 |
13 |
20 |
|
[ZN]B:602 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
20713 |
31.7 |
-23.5 |
0.000 |
0 |
0 |
0 |
0.195 |
21 |
|
[ZN]A:602 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
20975 |
31.6 |
-23.6 |
0.000 |
0 |
0 |
0 |
0.195 |
Average: |
31.6 |
-23.5 |
0.000 |
0 |
0 |
0 |
0.195 |
14 |
22 |
|
[PO4]A:605 |
4 |
1 |
192 |
f |
[ZN]A:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.0 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.094 |
23 |
|
[PO4]B:605 |
4 |
1 |
192 |
f |
[ZN]B:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.9 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.094 |
Average: |
22.9 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.094 |
15 |
24 |
|
[PO4]A:605 |
4 |
1 |
192 |
f |
[ZN]A:602 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.8 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.084 |
25 |
|
[PO4]B:605 |
4 |
1 |
192 |
f |
[ZN]B:602 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.8 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.084 |
Average: |
21.8 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.084 |
16 |
26 |
|
[ZN]B:602 |
1 |
1 |
98 |
f |
[ZN]B:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.8 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.042 |
17 |
27 |
|
[ZN]A:602 |
1 |
1 |
98 |
f |
[ZN]A:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.7 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.042 |
18 |
28 |
|
[O1Q]B:603 |
1 |
1 |
643 |
f |
[ZN]B:602 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.012 |
29 |
|
[O1Q]A:603 |
1 |
1 |
643 |
f |
[ZN]A:602 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.4 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.012 |
Average: |
4.5 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.012 |
19 |
30 |
|
B |
1 |
1 |
20713 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
20713 |
3.0 |
0.2 |
0.841 |
0 |
0 |
0 |
0.000 |
20 |
31 |
|
A |
1 |
1 |
20975 |
◊ |
B |
x-1,y,z-1 |
1_454 |
1 |
1 |
20713 |
2.7 |
0.1 |
0.786 |
0 |
0 |
0 |
0.000 |
|