## |
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 |
241 |
58 |
15284 |
◊ |
A |
x,y,z |
1_555 |
246 |
57 |
15188 |
2410.0 |
-28.1 |
0.016 |
32 |
15 |
0 |
0.402 |
2 |
|
D |
242 |
57 |
14938 |
◊ |
C |
x,y,z |
1_555 |
245 |
57 |
15196 |
2406.8 |
-28.2 |
0.015 |
32 |
14 |
0 |
0.402 |
Average: |
2408.4 |
-28.1 |
0.016 |
32 |
15 |
0 |
0.402 |
2 |
3 |
|
[FAD]C:2003 |
53 |
1 |
1000 |
f |
C |
x,y,z |
1_555 |
112 |
45 |
15196 |
737.3 |
-10.2 |
0.304 |
14 |
0 |
0 |
0.305 |
4 |
|
[FAD]B:2002 |
53 |
1 |
1000 |
f |
B |
x,y,z |
1_555 |
108 |
44 |
15284 |
728.0 |
-10.6 |
0.290 |
15 |
0 |
0 |
0.305 |
5 |
|
[FAD]A:2001 |
53 |
1 |
999 |
f |
A |
x,y,z |
1_555 |
103 |
42 |
15188 |
716.6 |
-10.4 |
0.298 |
14 |
0 |
0 |
0.305 |
6 |
|
[FAD]D:2004 |
53 |
1 |
999 |
f |
D |
x,y,z |
1_555 |
109 |
44 |
14938 |
711.4 |
-10.6 |
0.303 |
15 |
0 |
0 |
0.305 |
Average: |
723.3 |
-10.5 |
0.299 |
15 |
0 |
0 |
0.305 |
3 |
7 |
|
D |
61 |
21 |
14938 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
69 |
20 |
15188 |
605.2 |
3.5 |
0.788 |
8 |
4 |
0 |
0.000 |
4 |
8 |
|
C |
58 |
16 |
15196 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
53 |
19 |
15284 |
494.0 |
3.6 |
0.760 |
4 |
6 |
0 |
0.000 |
5 |
9 |
|
A |
38 |
10 |
15188 |
x |
A |
x-1/2,-y+3/2,-z |
4_465 |
31 |
12 |
15188 |
300.5 |
-2.5 |
0.343 |
2 |
0 |
0 |
0.000 |
10 |
|
C |
32 |
11 |
15196 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
34 |
10 |
15196 |
292.3 |
-2.0 |
0.384 |
3 |
1 |
0 |
0.000 |
Average: |
296.4 |
-2.3 |
0.364 |
3 |
1 |
0 |
0.000 |
6 |
11 |
|
C |
34 |
13 |
15196 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
40 |
12 |
15188 |
294.1 |
-1.6 |
0.459 |
3 |
0 |
0 |
0.000 |
12 |
|
D |
33 |
13 |
14938 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
31 |
13 |
15284 |
258.8 |
-2.2 |
0.381 |
1 |
0 |
0 |
0.000 |
Average: |
276.5 |
-1.9 |
0.420 |
2 |
0 |
0 |
0.000 |
7 |
13 |
|
B |
24 |
10 |
15284 |
◊ |
A |
x-1/2,-y+3/2,-z |
4_465 |
35 |
12 |
15188 |
273.9 |
0.6 |
0.650 |
4 |
0 |
0 |
0.000 |
14 |
|
C |
32 |
12 |
15196 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
27 |
11 |
14938 |
266.7 |
0.3 |
0.609 |
4 |
0 |
0 |
0.000 |
Average: |
270.3 |
0.5 |
0.629 |
4 |
0 |
0 |
0.000 |
8 |
15 |
|
B |
30 |
9 |
15284 |
◊ |
D |
-x+1/2,-y+1,z-1/2 |
2_564 |
27 |
11 |
14938 |
263.7 |
-0.5 |
0.509 |
1 |
0 |
0 |
0.000 |
9 |
16 |
|
A |
26 |
7 |
15188 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
26 |
8 |
15196 |
224.8 |
-2.2 |
0.337 |
0 |
3 |
0 |
0.000 |
10 |
17 |
|
D |
19 |
8 |
14938 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
22 |
9 |
15188 |
180.0 |
1.4 |
0.749 |
4 |
8 |
0 |
0.000 |
11 |
18 |
|
D |
17 |
5 |
14938 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
18 |
7 |
15196 |
142.7 |
2.2 |
0.820 |
2 |
3 |
0 |
0.000 |
19 |
|
A |
15 |
6 |
15188 |
◊ |
B |
x-1/2,-y+3/2,-z |
4_465 |
16 |
4 |
15284 |
132.1 |
2.8 |
0.874 |
2 |
4 |
0 |
0.000 |
Average: |
137.4 |
2.5 |
0.847 |
2 |
4 |
0 |
0.000 |
12 |
20 |
|
[SO4]A:4159 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
24 |
10 |
15188 |
113.4 |
-16.8 |
0.730 |
4 |
0 |
0 |
0.125 |
13 |
21 |
|
[SO4]B:4161 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
15284 |
113.4 |
-16.6 |
0.704 |
3 |
0 |
0 |
0.121 |
14 |
22 |
|
[SO4]D:4162 |
5 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
17 |
10 |
14938 |
111.7 |
-16.1 |
0.676 |
2 |
0 |
0 |
0.154 |
15 |
23 |
|
[SO4]B:4158 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
15284 |
109.4 |
-14.5 |
0.877 |
5 |
0 |
0 |
0.113 |
16 |
24 |
|
C |
14 |
5 |
15196 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
12 |
4 |
14938 |
106.6 |
1.0 |
0.738 |
0 |
0 |
0 |
0.000 |
17 |
25 |
|
[SO4]A:4157 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
15188 |
106.3 |
-14.5 |
0.839 |
5 |
0 |
0 |
0.113 |
18 |
26 |
|
[SO4]C:4163 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
15196 |
105.9 |
-14.5 |
0.831 |
3 |
0 |
0 |
0.143 |
19 |
27 |
|
B |
8 |
3 |
15284 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
12 |
6 |
15188 |
74.6 |
-0.6 |
0.454 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
B |
7 |
3 |
15284 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
9 |
4 |
14938 |
67.1 |
-1.4 |
0.259 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[SO4]C:4163 |
4 |
1 |
184 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
1 |
14938 |
34.4 |
-4.0 |
0.760 |
0 |
0 |
0 |
0.000 |
22 |
30 |
|
C |
4 |
2 |
15196 |
◊ |
[SO4]B:4158 |
-x+1,y-1/2,-z-1/2 |
3_644 |
3 |
1 |
184 |
24.4 |
-3.3 |
0.583 |
0 |
0 |
0 |
0.000 |
23 |
31 |
|
[FAD]C:2003 |
5 |
1 |
1000 |
◊ |
D |
x,y,z |
1_555 |
2 |
2 |
14938 |
18.3 |
0.5 |
0.741 |
1 |
0 |
0 |
0.000 |
32 |
|
[FAD]A:2001 |
5 |
1 |
999 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
15284 |
18.0 |
0.4 |
0.730 |
1 |
0 |
0 |
0.000 |
33 |
|
[FAD]D:2004 |
3 |
1 |
999 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
15196 |
14.4 |
0.4 |
0.723 |
0 |
0 |
0 |
0.000 |
34 |
|
[FAD]B:2002 |
3 |
1 |
1000 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15188 |
14.0 |
0.3 |
0.712 |
0 |
0 |
0 |
0.000 |
Average: |
16.2 |
0.4 |
0.726 |
1 |
0 |
0 |
0.000 |
24 |
35 |
|
D |
2 |
1 |
14938 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
15188 |
6.0 |
0.3 |
0.796 |
0 |
0 |
0 |
0.000 |
25 |
36 |
|
C |
1 |
1 |
15196 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
15284 |
2.4 |
0.1 |
0.740 |
0 |
0 |
0 |
0.000 |
26 |
37 |
|
B |
2 |
1 |
15284 |
◊ |
D |
-x+3/2,-y+1,z-1/2 |
2_664 |
2 |
2 |
14938 |
2.2 |
-0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
|