| ## |
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 |
288 |
66 |
16211 |
◊ |
A |
x,y,z |
1_555 |
287 |
65 |
16762 |
2872.2 |
-36.2 |
0.110 |
26 |
9 |
0 |
0.230 |
| 2 |
2 |
|
[FAD]A:400 |
52 |
1 |
989 |
f |
A |
x,y,z |
1_555 |
123 |
44 |
16762 |
725.3 |
-10.2 |
0.468 |
6 |
0 |
0 |
0.120 |
3 |
|
[FAD]B:400 |
53 |
1 |
987 |
f |
B |
x,y,z |
1_555 |
122 |
44 |
16211 |
724.9 |
-9.7 |
0.500 |
7 |
0 |
0 |
0.120 |
| Average: |
725.1 |
-10.0 |
0.484 |
7 |
0 |
0 |
0.120 |
| 3 |
4 |
|
[FAD]A:401 |
47 |
1 |
974 |
f |
A |
x,y,z |
1_555 |
86 |
21 |
16762 |
594.3 |
-5.8 |
0.525 |
3 |
0 |
0 |
0.065 |
5 |
|
[FAD]B:401 |
46 |
1 |
967 |
f |
B |
x,y,z |
1_555 |
86 |
23 |
16211 |
576.2 |
-5.7 |
0.548 |
2 |
0 |
0 |
0.065 |
| Average: |
585.3 |
-5.8 |
0.536 |
3 |
0 |
0 |
0.065 |
| 4 |
6 |
|
A |
58 |
24 |
16762 |
◊ |
A |
-x,-y,z |
2_555 |
58 |
24 |
16762 |
456.6 |
-3.4 |
0.582 |
0 |
0 |
0 |
0.000 |
| 5 |
7 |
|
A |
34 |
12 |
16762 |
◊ |
A |
-x,y,-z |
3_555 |
34 |
12 |
16762 |
333.6 |
1.9 |
0.871 |
2 |
2 |
0 |
0.000 |
| 6 |
8 |
|
B |
41 |
15 |
16211 |
◊ |
A |
x-1,y,z |
1_455 |
38 |
14 |
16762 |
308.0 |
0.3 |
0.682 |
0 |
0 |
0 |
0.000 |
| 7 |
9 |
|
B |
37 |
9 |
16211 |
x |
B |
x-1/2,-y-1/2,-z-1/2 |
8_444 |
33 |
7 |
16211 |
284.5 |
-0.6 |
0.723 |
1 |
0 |
0 |
0.000 |
| 8 |
10 |
|
A |
32 |
9 |
16762 |
◊ |
A |
x,-y,-z |
4_555 |
32 |
9 |
16762 |
241.9 |
-3.7 |
0.373 |
0 |
0 |
0 |
0.000 |
| 9 |
11 |
|
B |
24 |
9 |
16211 |
◊ |
A |
x-1/2,-y-1/2,-z-1/2 |
8_444 |
29 |
9 |
16762 |
212.5 |
-0.4 |
0.711 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[SO4]B:404 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
16211 |
90.0 |
-12.2 |
0.833 |
2 |
0 |
0 |
0.061 |
| 11 |
13 |
|
[SO4]A:406 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
16762 |
86.9 |
-12.8 |
0.745 |
1 |
0 |
0 |
0.062 |
| 12 |
14 |
|
[SO4]A:405 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
16762 |
82.1 |
-11.4 |
0.784 |
1 |
0 |
0 |
0.055 |
| 13 |
15 |
|
[SO4]B:405 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
16211 |
79.8 |
-11.2 |
0.867 |
1 |
0 |
0 |
0.054 |
| 14 |
16 |
|
[SO4]B:406 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
16211 |
77.4 |
-8.9 |
0.952 |
1 |
0 |
0 |
0.044 |
| 15 |
17 |
|
[SO4]B:402 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
16211 |
77.1 |
-11.9 |
0.620 |
0 |
0 |
0 |
0.055 |
| 16 |
18 |
|
[SO4]B:403 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
16211 |
69.3 |
-10.6 |
0.652 |
1 |
0 |
0 |
0.051 |
| 17 |
19 |
|
[SO4]A:404 |
5 |
1 |
187 |
cf |
A |
x,y,z |
1_555 |
7 |
2 |
16762 |
62.9 |
-8.3 |
0.914 |
2 |
0 |
0 |
0.043 |
| 18 |
20 |
|
[SO4]A:407 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
16762 |
59.3 |
-7.0 |
0.873 |
0 |
0 |
0 |
0.033 |
| 19 |
21 |
|
[SO4]A:403 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
16762 |
55.7 |
-7.5 |
0.743 |
1 |
0 |
0 |
0.037 |
| 20 |
22 |
|
B |
8 |
5 |
16211 |
f |
[SO4]A:402 |
x-1/2,-y-1/2,-z-1/2 |
8_444 |
4 |
1 |
187 |
55.5 |
-7.3 |
0.695 |
0 |
0 |
0 |
0.034 |
| 21 |
23 |
|
[SO4]A:405 |
4 |
1 |
186 |
f |
[FAD]A:401 |
x,y,z |
1_555 |
6 |
1 |
974 |
48.4 |
-6.1 |
0.757 |
1 |
0 |
0 |
0.031 |
| 22 |
24 |
|
[SO4]A:402 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
7 |
1 |
16762 |
47.9 |
-5.9 |
0.871 |
1 |
0 |
0 |
0.000 |
| 23 |
25 |
|
B |
3 |
2 |
16211 |
◊ |
B |
-x-1,y,-z |
3_455 |
3 |
2 |
16211 |
43.0 |
-1.4 |
0.127 |
0 |
0 |
0 |
0.000 |
| 24 |
26 |
|
[FAD]A:401 |
4 |
1 |
974 |
f |
[FAD]A:400 |
x,y,z |
1_555 |
2 |
1 |
989 |
40.3 |
-1.3 |
0.364 |
0 |
0 |
0 |
0.012 |
27 |
|
[FAD]B:401 |
3 |
1 |
967 |
f |
[FAD]B:400 |
x,y,z |
1_555 |
2 |
1 |
987 |
38.2 |
-1.2 |
0.349 |
0 |
0 |
0 |
0.012 |
| Average: |
39.3 |
-1.2 |
0.357 |
0 |
0 |
0 |
0.012 |
| 25 |
28 |
|
[SO4]A:404 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
16211 |
29.8 |
-3.6 |
0.374 |
0 |
0 |
0 |
0.017 |
| 26 |
29 |
|
B |
1 |
1 |
16211 |
◊ |
[FAD]A:401 |
x-1,y,z |
1_455 |
2 |
1 |
974 |
17.0 |
0.4 |
0.727 |
0 |
0 |
0 |
0.000 |
| 27 |
30 |
|
[FAD]B:400 |
4 |
1 |
987 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
16762 |
15.8 |
0.3 |
0.717 |
0 |
0 |
0 |
0.000 |
31 |
|
[FAD]A:400 |
4 |
1 |
989 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
16211 |
14.9 |
0.3 |
0.720 |
0 |
0 |
0 |
0.000 |
| Average: |
15.4 |
0.3 |
0.718 |
0 |
0 |
0 |
0.000 |
| 28 |
32 |
|
[SO4]A:402 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
16211 |
14.8 |
-1.8 |
0.791 |
0 |
0 |
0 |
0.000 |
| 29 |
33 |
|
[SO4]B:403 |
3 |
1 |
184 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
16762 |
13.6 |
-1.6 |
0.567 |
0 |
0 |
0 |
0.000 |
| 30 |
34 |
|
[SO4]B:402 |
2 |
1 |
185 |
◊ |
B |
x-1/2,-y-1/2,-z-1/2 |
8_444 |
2 |
1 |
16211 |
11.8 |
-1.0 |
0.941 |
0 |
0 |
0 |
0.000 |
| 31 |
35 |
|
B |
2 |
1 |
16211 |
◊ |
[SO4]A:407 |
x-1,y,z |
1_455 |
1 |
1 |
186 |
1.1 |
-0.1 |
0.809 |
0 |
0 |
0 |
0.000 |
|