## |
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 |
433 |
107 |
19516 |
◊ |
A |
x,y,z |
1_555 |
444 |
105 |
18661 |
4457.1 |
-54.6 |
0.029 |
49 |
17 |
0 |
0.342 |
2 |
2 |
|
B |
48 |
14 |
19516 |
◊ |
A |
x-1,y,z |
1_455 |
47 |
12 |
18661 |
452.1 |
-1.5 |
0.619 |
2 |
4 |
0 |
0.000 |
3 |
3 |
|
B |
55 |
15 |
19516 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
46 |
12 |
18661 |
424.8 |
-1.1 |
0.668 |
4 |
2 |
0 |
0.000 |
4 |
4 |
|
B |
48 |
19 |
19516 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
43 |
15 |
18661 |
403.1 |
-5.4 |
0.275 |
2 |
0 |
0 |
0.000 |
5 |
5 |
|
[FMN]A:2400 |
31 |
1 |
635 |
f |
A |
x,y,z |
1_555 |
61 |
19 |
18661 |
372.0 |
-5.1 |
0.630 |
17 |
0 |
0 |
0.110 |
6 |
|
[FMN]B:2400 |
31 |
1 |
637 |
f |
B |
x,y,z |
1_555 |
59 |
19 |
19516 |
368.8 |
-4.7 |
0.643 |
18 |
0 |
0 |
0.110 |
Average: |
370.4 |
-4.9 |
0.636 |
18 |
0 |
0 |
0.110 |
6 |
7 |
|
[AMP]A:2401 |
23 |
1 |
498 |
f |
A |
x,y,z |
1_555 |
49 |
19 |
18661 |
338.5 |
-3.2 |
0.567 |
11 |
0 |
0 |
0.072 |
8 |
|
[AMP]B:2401 |
23 |
1 |
501 |
f |
B |
x,y,z |
1_555 |
41 |
20 |
19516 |
311.0 |
-4.5 |
0.456 |
9 |
0 |
0 |
0.072 |
Average: |
324.8 |
-3.8 |
0.512 |
10 |
0 |
0 |
0.072 |
7 |
9 |
|
B |
29 |
7 |
19516 |
x |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
31 |
8 |
19516 |
249.6 |
-0.9 |
0.624 |
4 |
4 |
0 |
0.000 |
8 |
10 |
|
[GSH]B:1 |
19 |
1 |
506 |
f |
A |
x,y,z |
1_555 |
32 |
9 |
18661 |
204.9 |
-3.0 |
0.649 |
3 |
0 |
0 |
0.019 |
9 |
11 |
|
[GSH]B:1 |
17 |
1 |
506 |
◊ |
B |
x,y,z |
1_555 |
26 |
9 |
19516 |
176.2 |
-2.0 |
0.728 |
4 |
0 |
0 |
0.016 |
10 |
12 |
|
A |
14 |
6 |
18661 |
◊ |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
15 |
5 |
19516 |
118.9 |
-0.0 |
0.507 |
1 |
0 |
0 |
0.000 |
11 |
13 |
|
[SO4]B:1177 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
22 |
8 |
19516 |
104.3 |
-17.0 |
0.586 |
1 |
0 |
0 |
0.075 |
12 |
14 |
|
[ZN]A:2402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
18661 |
46.8 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.225 |
15 |
|
[ZN]B:2402 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
19516 |
46.0 |
-25.8 |
0.000 |
0 |
0 |
0 |
0.225 |
Average: |
46.4 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.225 |
13 |
16 |
|
[FMN]A:2400 |
4 |
1 |
635 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
19516 |
44.9 |
-0.2 |
0.616 |
0 |
0 |
0 |
0.003 |
17 |
|
[FMN]B:2400 |
5 |
1 |
637 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
18661 |
39.6 |
-0.4 |
0.603 |
0 |
0 |
0 |
0.003 |
Average: |
42.2 |
-0.3 |
0.610 |
0 |
0 |
0 |
0.003 |
14 |
18 |
|
[SO4]B:1177 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
18661 |
41.6 |
-4.2 |
0.942 |
2 |
0 |
0 |
0.022 |
15 |
19 |
|
[ZN]B:2402 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
18661 |
28.5 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.110 |
20 |
|
[ZN]A:2402 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
19516 |
28.3 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.110 |
Average: |
28.4 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.110 |
16 |
21 |
|
[AMP]A:2401 |
3 |
1 |
498 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
19516 |
19.5 |
-0.1 |
0.615 |
0 |
0 |
0 |
0.002 |
22 |
|
[AMP]B:2401 |
3 |
1 |
501 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
18661 |
14.0 |
-0.3 |
0.587 |
0 |
0 |
0 |
0.002 |
Average: |
16.7 |
-0.2 |
0.601 |
0 |
0 |
0 |
0.002 |
17 |
23 |
|
[GSH]B:1 |
3 |
1 |
506 |
f |
[AMP]A:2401 |
x,y,z |
1_555 |
2 |
1 |
498 |
17.5 |
-0.9 |
0.444 |
0 |
0 |
0 |
0.004 |
|