| ## |
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 |
359 |
95 |
21098 |
◊ |
A |
x,y,z |
1_555 |
356 |
92 |
21066 |
3541.1 |
-50.6 |
0.001 |
34 |
9 |
0 |
0.507 |
| 2 |
2 |
|
D |
94 |
24 |
4513 |
◊ |
B |
x,y,z |
1_555 |
109 |
35 |
21098 |
974.7 |
-11.6 |
0.248 |
6 |
2 |
0 |
0.195 |
3 |
|
C |
95 |
24 |
4522 |
◊ |
A |
x,y,z |
1_555 |
105 |
34 |
21066 |
970.0 |
-11.7 |
0.238 |
6 |
2 |
0 |
0.195 |
| Average: |
972.4 |
-11.7 |
0.243 |
6 |
2 |
0 |
0.195 |
| 3 |
4 |
|
[FAD]A:599 |
53 |
1 |
961 |
cf |
A |
x,y,z |
1_555 |
100 |
37 |
21066 |
704.3 |
-8.0 |
0.560 |
28 |
0 |
0 |
0.305 |
5 |
|
[FAD]B:599 |
53 |
1 |
959 |
cf |
B |
x,y,z |
1_555 |
100 |
38 |
21098 |
701.3 |
-7.8 |
0.569 |
27 |
0 |
0 |
0.305 |
| Average: |
702.8 |
-7.9 |
0.564 |
28 |
0 |
0 |
0.305 |
| 4 |
6 |
|
[HEM]D:699 |
43 |
1 |
851 |
cf |
D |
x,y,z |
1_555 |
64 |
26 |
4513 |
575.9 |
-22.7 |
0.217 |
6 |
0 |
0 |
0.340 |
7 |
|
[HEM]C:699 |
43 |
1 |
850 |
cf |
C |
x,y,z |
1_555 |
63 |
26 |
4522 |
575.3 |
-23.0 |
0.202 |
6 |
0 |
0 |
0.340 |
| Average: |
575.6 |
-22.8 |
0.209 |
6 |
0 |
0 |
0.340 |
| 5 |
8 |
|
D |
37 |
10 |
4513 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
47 |
14 |
21066 |
332.9 |
-4.0 |
0.440 |
0 |
0 |
0 |
0.024 |
| 6 |
9 |
|
B |
36 |
11 |
21098 |
◊ |
C |
x-1/2,-y+1/2,-z-1 |
4_454 |
26 |
7 |
4522 |
255.1 |
-1.0 |
0.681 |
2 |
1 |
0 |
0.013 |
| 7 |
10 |
|
B |
16 |
6 |
21098 |
x |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
12 |
5 |
21098 |
107.2 |
1.2 |
0.833 |
2 |
1 |
0 |
0.000 |
| 8 |
11 |
|
[HEM]C:699 |
7 |
1 |
850 |
◊ |
A |
x,y,z |
1_555 |
16 |
8 |
21066 |
101.9 |
-2.5 |
0.586 |
0 |
0 |
0 |
0.033 |
12 |
|
[HEM]D:699 |
7 |
1 |
851 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
21098 |
99.7 |
-2.4 |
0.597 |
0 |
0 |
0 |
0.033 |
| Average: |
100.8 |
-2.5 |
0.592 |
0 |
0 |
0 |
0.033 |
| 9 |
13 |
|
[CL]B:702 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
21098 |
66.4 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.188 |
14 |
|
[CL]A:701 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
21066 |
66.2 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.188 |
| Average: |
66.3 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.188 |
| 10 |
15 |
|
A |
9 |
4 |
21066 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
6 |
2 |
21098 |
52.5 |
2.5 |
0.950 |
1 |
0 |
0 |
0.000 |
| 11 |
16 |
|
[HEM]D:699 |
3 |
1 |
851 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
6 |
2 |
21066 |
43.9 |
-1.9 |
0.390 |
1 |
0 |
0 |
0.014 |
| 12 |
17 |
|
B |
5 |
3 |
21098 |
◊ |
[HEM]C:699 |
x-1/2,-y+1/2,-z-1 |
4_454 |
3 |
1 |
850 |
42.5 |
-1.2 |
0.461 |
1 |
0 |
0 |
0.010 |
| 13 |
18 |
|
C |
4 |
2 |
4522 |
◊ |
B |
x,y,z-1 |
1_554 |
4 |
1 |
21098 |
24.0 |
-0.2 |
0.539 |
0 |
0 |
0 |
0.000 |
19 |
|
A |
5 |
2 |
21066 |
◊ |
D |
x,y,z-1 |
1_554 |
5 |
2 |
4513 |
22.5 |
-0.3 |
0.561 |
0 |
0 |
0 |
0.000 |
| Average: |
23.2 |
-0.3 |
0.550 |
0 |
0 |
0 |
0.000 |
| 14 |
20 |
|
A |
2 |
2 |
21066 |
◊ |
B |
x,y,z-1 |
1_554 |
2 |
2 |
21098 |
15.4 |
0.4 |
0.846 |
0 |
0 |
0 |
0.000 |
|