| ## |
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 |
128 |
35 |
10790 |
◊ |
A |
x,y,z |
1_555 |
134 |
38 |
10612 |
1165.4 |
-11.2 |
0.356 |
7 |
2 |
0 |
0.068 |
| 2 |
2 |
|
A |
52 |
12 |
10612 |
◊ |
B |
-y,x-y-1,z+1/3 |
2_545 |
51 |
9 |
10790 |
423.0 |
-2.9 |
0.522 |
3 |
4 |
0 |
0.000 |
| 3 |
3 |
|
[PO4]A:1275 |
5 |
1 |
191 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
10612 |
103.1 |
-7.9 |
0.485 |
3 |
0 |
0 |
0.043 |
| 4 |
4 |
|
[PO4]B:1275 |
5 |
1 |
192 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
10790 |
98.3 |
-8.1 |
0.432 |
2 |
0 |
0 |
0.042 |
| 5 |
5 |
|
A |
14 |
4 |
10612 |
x |
A |
x-1,y,z |
1_455 |
6 |
2 |
10612 |
96.6 |
-0.5 |
0.433 |
1 |
0 |
0 |
0.000 |
6 |
|
B |
6 |
2 |
10790 |
x |
B |
x-1,y,z |
1_455 |
12 |
3 |
10790 |
84.0 |
0.4 |
0.739 |
0 |
0 |
0 |
0.000 |
| Average: |
90.3 |
-0.1 |
0.586 |
1 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[EDO]B:1277 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
10790 |
88.9 |
2.8 |
0.313 |
4 |
0 |
0 |
0.000 |
| 7 |
8 |
|
[NI]A:1276 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
10612 |
46.8 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.057 |
9 |
|
[NI]B:1276 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
10790 |
45.9 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.057 |
| Average: |
46.4 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.057 |
| 8 |
10 |
|
[NI]A:1276 |
1 |
1 |
115 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
10790 |
43.5 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.047 |
11 |
|
[NI]B:1276 |
1 |
1 |
115 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
10612 |
42.7 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.047 |
| Average: |
43.1 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.047 |
| 9 |
12 |
|
B |
6 |
1 |
10790 |
x |
B |
x,y-1,z |
1_545 |
3 |
1 |
10790 |
40.9 |
-0.9 |
0.306 |
0 |
0 |
0 |
0.000 |
13 |
|
A |
1 |
1 |
10612 |
x |
A |
x-1,y-1,z |
1_445 |
1 |
1 |
10612 |
3.3 |
-0.1 |
0.386 |
0 |
0 |
0 |
0.000 |
| Average: |
22.1 |
-0.5 |
0.346 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[ZN]A:1273 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
10612 |
34.8 |
-23.7 |
0.000 |
0 |
0 |
0 |
0.220 |
15 |
|
[ZN]B:1274 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
10790 |
34.5 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.220 |
| Average: |
34.6 |
-23.8 |
0.000 |
0 |
0 |
0 |
0.220 |
| 11 |
16 |
|
[ZN]A:1274 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
10612 |
33.9 |
-25.2 |
0.000 |
0 |
0 |
0 |
0.236 |
17 |
|
[ZN]B:1273 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
10790 |
33.9 |
-25.6 |
0.000 |
0 |
0 |
0 |
0.236 |
| Average: |
33.9 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.236 |
| 12 |
18 |
|
[PO4]B:1275 |
1 |
1 |
192 |
cf |
[ZN]B:1273 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.1 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.160 |
19 |
|
[PO4]B:1275 |
4 |
1 |
192 |
f |
[ZN]B:1274 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.1 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.160 |
20 |
|
[PO4]A:1275 |
4 |
1 |
191 |
f |
[ZN]A:1273 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.5 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.160 |
| Average: |
25.9 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.160 |
| 13 |
21 |
|
[PO4]A:1275 |
3 |
1 |
191 |
cf |
[ZN]A:1274 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.2 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.049 |
| 14 |
22 |
|
[ZN]B:1274 |
1 |
1 |
98 |
f |
[ZN]B:1273 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.3 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.042 |
| 15 |
23 |
|
[ZN]A:1274 |
1 |
1 |
98 |
f |
[ZN]A:1273 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.1 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.041 |
| 16 |
24 |
|
A |
2 |
2 |
10612 |
◊ |
B |
-y,x-y,z+1/3 |
2_555 |
5 |
3 |
10790 |
10.8 |
-0.3 |
0.423 |
0 |
0 |
0 |
0.000 |
| 17 |
25 |
|
A |
2 |
2 |
10612 |
x |
A |
x,y-1,z |
1_545 |
3 |
1 |
10612 |
10.4 |
-0.3 |
0.424 |
0 |
0 |
0 |
0.000 |
| 18 |
26 |
|
A |
1 |
1 |
10612 |
◊ |
B |
x-1,y-1,z |
1_445 |
1 |
1 |
10790 |
6.3 |
-0.2 |
0.293 |
0 |
0 |
0 |
0.000 |
|