| ## |
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 |
67 |
26 |
11378 |
◊ |
A |
x,y,z |
1_555 |
67 |
25 |
11336 |
575.3 |
0.3 |
0.753 |
5 |
6 |
0 |
0.000 |
| 2 |
2 |
|
B |
37 |
9 |
11378 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
56 |
14 |
11336 |
446.5 |
-4.7 |
0.217 |
8 |
0 |
0 |
0.000 |
3 |
|
A |
35 |
9 |
11336 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
56 |
14 |
11378 |
440.8 |
-5.6 |
0.146 |
6 |
0 |
0 |
0.000 |
| Average: |
443.6 |
-5.2 |
0.181 |
7 |
0 |
0 |
0.000 |
| 3 |
4 |
|
[83Y]A:404 |
14 |
1 |
342 |
f |
A |
x,y,z |
1_555 |
25 |
13 |
11336 |
187.5 |
4.0 |
0.339 |
6 |
0 |
0 |
0.000 |
5 |
|
[83Y]B:404 |
14 |
1 |
342 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
11378 |
186.3 |
3.9 |
0.354 |
6 |
0 |
0 |
0.000 |
| Average: |
186.9 |
4.0 |
0.346 |
6 |
0 |
0 |
0.000 |
| 4 |
6 |
|
[PO4]A:402 |
5 |
1 |
190 |
f |
A |
x,y,z |
1_555 |
25 |
11 |
11336 |
119.5 |
-8.1 |
0.573 |
3 |
0 |
0 |
0.207 |
| 5 |
7 |
|
[PO4]B:402 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
24 |
10 |
11378 |
114.5 |
-7.2 |
0.718 |
5 |
0 |
0 |
0.173 |
| 6 |
8 |
|
[PO4]B:403 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
11378 |
94.5 |
-4.3 |
0.920 |
5 |
0 |
0 |
0.120 |
| 7 |
9 |
|
[BDP]A:405 |
9 |
1 |
297 |
f |
A |
x,y,z |
1_555 |
11 |
8 |
11336 |
94.5 |
2.5 |
0.376 |
2 |
0 |
0 |
0.000 |
10 |
|
[BDP]B:405 |
11 |
1 |
299 |
f |
B |
x,y,z |
1_555 |
12 |
8 |
11378 |
93.7 |
2.4 |
0.287 |
2 |
0 |
0 |
0.000 |
| Average: |
94.1 |
2.5 |
0.332 |
2 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[PO4]A:403 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
11336 |
89.6 |
-4.2 |
0.917 |
4 |
0 |
0 |
0.130 |
| 9 |
12 |
|
[GCD]B:407 |
9 |
1 |
293 |
cf |
[83Y]B:406 |
x,y,z |
1_555 |
7 |
1 |
351 |
80.2 |
3.7 |
0.256 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[GCD]A:407 |
9 |
1 |
289 |
cf |
[83Y]A:406 |
x,y,z |
1_555 |
8 |
1 |
351 |
78.3 |
3.2 |
0.197 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[BDP]A:405 |
9 |
1 |
297 |
cf |
[83Y]A:404 |
x,y,z |
1_555 |
8 |
1 |
342 |
76.9 |
2.5 |
0.101 |
0 |
0 |
0 |
0.000 |
15 |
|
[BDP]B:405 |
9 |
1 |
299 |
cf |
[83Y]B:404 |
x,y,z |
1_555 |
8 |
1 |
342 |
75.5 |
2.5 |
0.104 |
0 |
0 |
0 |
0.000 |
| Average: |
76.2 |
2.5 |
0.103 |
0 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[BDP]A:405 |
7 |
1 |
297 |
cf |
[83Y]A:406 |
x,y,z |
1_555 |
6 |
1 |
351 |
64.7 |
2.8 |
0.243 |
0 |
0 |
0 |
0.000 |
17 |
|
[BDP]B:405 |
7 |
1 |
299 |
cf |
[83Y]B:406 |
x,y,z |
1_555 |
7 |
1 |
351 |
64.2 |
2.7 |
0.189 |
0 |
0 |
0 |
0.000 |
| Average: |
64.4 |
2.7 |
0.216 |
0 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[EDO]B:408 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
11378 |
63.8 |
1.7 |
0.850 |
0 |
0 |
0 |
0.000 |
| 14 |
19 |
|
[83Y]B:406 |
6 |
1 |
351 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
11378 |
63.0 |
0.5 |
0.230 |
3 |
0 |
0 |
0.016 |
20 |
|
[83Y]A:406 |
7 |
1 |
351 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
11336 |
62.7 |
0.6 |
0.203 |
3 |
0 |
0 |
0.016 |
| Average: |
62.8 |
0.5 |
0.216 |
3 |
0 |
0 |
0.016 |
| 15 |
21 |
|
[EDO]B:408 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
11336 |
45.4 |
1.2 |
0.881 |
0 |
0 |
0 |
0.000 |
| 16 |
22 |
|
[83Y]B:404 |
3 |
1 |
342 |
f |
[PO4]B:402 |
x,y,z |
1_555 |
4 |
1 |
187 |
33.3 |
-0.7 |
0.550 |
0 |
0 |
0 |
0.014 |
| 17 |
23 |
|
[83Y]A:404 |
3 |
1 |
342 |
f |
[PO4]A:402 |
x,y,z |
1_555 |
4 |
1 |
190 |
31.8 |
-0.8 |
0.538 |
0 |
0 |
0 |
0.017 |
| 18 |
24 |
|
[EDO]B:408 |
3 |
1 |
185 |
f |
[PO4]A:403 |
x,y,z |
1_555 |
1 |
1 |
188 |
15.8 |
-0.5 |
0.894 |
0 |
0 |
0 |
0.012 |
| 19 |
25 |
|
[GCD]B:407 |
2 |
1 |
293 |
f |
[BDP]B:405 |
x,y,z |
1_555 |
3 |
1 |
299 |
13.1 |
0.4 |
0.239 |
0 |
0 |
0 |
0.000 |
26 |
|
[GCD]A:407 |
2 |
1 |
289 |
f |
[BDP]A:405 |
x,y,z |
1_555 |
3 |
1 |
297 |
8.7 |
0.3 |
0.227 |
0 |
0 |
0 |
0.000 |
| Average: |
10.9 |
0.4 |
0.233 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
[PO4]A:403 |
3 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
11378 |
13.0 |
-0.4 |
0.888 |
0 |
0 |
0 |
0.000 |
| 21 |
28 |
|
[PO4]B:403 |
3 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
11336 |
9.2 |
-0.4 |
0.893 |
0 |
0 |
0 |
0.000 |
| 22 |
29 |
|
A |
1 |
1 |
11336 |
◊ |
[83Y]B:406 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
351 |
8.5 |
-0.0 |
0.255 |
0 |
0 |
0 |
0.000 |
30 |
|
B |
1 |
1 |
11378 |
◊ |
[83Y]A:406 |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
351 |
4.8 |
-0.0 |
0.258 |
0 |
0 |
0 |
0.000 |
| Average: |
6.7 |
-0.0 |
0.256 |
0 |
0 |
0 |
0.000 |
| 23 |
31 |
|
[EDO]B:408 |
1 |
1 |
185 |
◊ |
[PO4]B:403 |
x,y,z |
1_555 |
1 |
1 |
188 |
3.0 |
-0.1 |
0.894 |
0 |
0 |
0 |
0.000 |
|