| ## |
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 |
95 |
30 |
15211 |
◊ |
B |
-y,-x,-z+1/6 |
10_555 |
96 |
30 |
15211 |
918.4 |
-11.6 |
0.068 |
4 |
0 |
0 |
0.019 |
| 2 |
2 |
|
[FAD]A:401 |
53 |
1 |
1002 |
f |
A |
x,y,z |
1_555 |
119 |
50 |
15938 |
733.9 |
-7.0 |
0.466 |
19 |
0 |
0 |
0.420 |
3 |
|
[FAD]B:403 |
52 |
1 |
1000 |
f |
B |
x,y,z |
1_555 |
118 |
50 |
15211 |
724.1 |
-7.0 |
0.511 |
21 |
0 |
0 |
0.420 |
| Average: |
729.0 |
-7.0 |
0.488 |
20 |
0 |
0 |
0.420 |
| 3 |
4 |
|
B |
77 |
21 |
15211 |
◊ |
A |
x-y,-y,-z |
8_555 |
77 |
20 |
15938 |
702.8 |
-14.1 |
0.008 |
7 |
0 |
0 |
0.228 |
| 4 |
5 |
|
A |
80 |
20 |
15938 |
◊ |
A |
x-y,-y,-z |
8_555 |
80 |
20 |
15938 |
657.9 |
-0.6 |
0.626 |
4 |
2 |
0 |
0.047 |
6 |
|
B |
71 |
17 |
15211 |
◊ |
B |
x-y,-y,-z |
8_555 |
71 |
17 |
15211 |
590.1 |
-3.2 |
0.450 |
2 |
4 |
0 |
0.047 |
| Average: |
624.0 |
-1.9 |
0.538 |
3 |
3 |
0 |
0.047 |
| 5 |
7 |
|
A |
65 |
17 |
15938 |
◊ |
B |
x-1,y,z |
1_455 |
68 |
18 |
15211 |
632.0 |
0.8 |
0.673 |
11 |
5 |
0 |
0.000 |
| 6 |
8 |
|
B |
54 |
19 |
15211 |
◊ |
A |
x,y,z |
1_555 |
55 |
19 |
15938 |
446.6 |
-3.8 |
0.325 |
3 |
0 |
0 |
0.050 |
| 7 |
9 |
|
A |
30 |
7 |
15938 |
◊ |
B |
x-y,-y+1,-z |
8_565 |
38 |
11 |
15211 |
300.8 |
2.2 |
0.830 |
4 |
3 |
0 |
0.000 |
| 8 |
10 |
|
A |
25 |
7 |
15938 |
◊ |
B |
x-y,x+1,z-1/6 |
6_564 |
25 |
8 |
15211 |
221.9 |
-1.2 |
0.369 |
3 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[IPA]B:405 |
4 |
1 |
198 |
f |
B |
x,y,z |
1_555 |
25 |
11 |
15211 |
127.5 |
4.8 |
0.435 |
2 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[SO4]A:402 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
15938 |
89.8 |
-12.0 |
0.895 |
4 |
0 |
0 |
0.183 |
| 11 |
13 |
|
[SO4]B:407 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
15211 |
88.6 |
-12.5 |
0.846 |
4 |
0 |
0 |
0.286 |
| 12 |
14 |
|
[SO4]B:406 |
5 |
1 |
185 |
f |
[SO4]B:406 |
x-y,-y,-z |
8_555 |
5 |
1 |
185 |
75.7 |
-17.1 |
0.993 |
0 |
0 |
0 |
0.171 |
| 13 |
15 |
|
[SO4]B:406 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
15211 |
48.4 |
-4.0 |
0.985 |
3 |
0 |
0 |
0.106 |
| 14 |
16 |
|
A |
10 |
3 |
15938 |
x |
A |
x-y,-y+1,-z |
8_565 |
8 |
3 |
15938 |
46.6 |
-0.4 |
0.497 |
0 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[SO4]B:406 |
3 |
1 |
185 |
◊ |
B |
x-y,-y,-z |
8_555 |
2 |
1 |
15211 |
37.6 |
-3.4 |
0.981 |
3 |
0 |
0 |
0.096 |
| 16 |
18 |
|
[CL]B:404 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
15211 |
24.2 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.046 |
| 17 |
19 |
|
[FAD]A:401 |
1 |
1 |
1002 |
◊ |
A |
x-y,-y,-z |
8_555 |
2 |
1 |
15938 |
4.1 |
0.0 |
0.506 |
0 |
0 |
0 |
0.000 |
20 |
|
[FAD]B:403 |
1 |
1 |
1000 |
◊ |
B |
x-y,-y,-z |
8_555 |
2 |
1 |
15211 |
2.6 |
0.0 |
0.519 |
0 |
0 |
0 |
0.000 |
| Average: |
3.4 |
0.0 |
0.513 |
0 |
0 |
0 |
0.000 |
|