## |
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 |
|
[FAD]B:501 |
52 |
1 |
1002 |
f |
B |
x,y,z |
1_555 |
103 |
42 |
20712 |
675.5 |
-5.8 |
0.551 |
17 |
0 |
0 |
0.029 |
2 |
|
[FAD]A:501 |
51 |
1 |
1008 |
f |
A |
x,y,z |
1_555 |
98 |
44 |
20854 |
663.5 |
-5.0 |
0.577 |
18 |
0 |
0 |
0.029 |
Average: |
669.5 |
-5.4 |
0.564 |
18 |
0 |
0 |
0.029 |
2 |
3 |
|
A |
58 |
18 |
20854 |
◊ |
B |
x,y-1,z |
1_545 |
54 |
14 |
20712 |
564.5 |
-2.7 |
0.294 |
7 |
4 |
0 |
0.000 |
3 |
4 |
|
B |
48 |
16 |
20712 |
x |
B |
-x-1,y-1/2,-z |
2_445 |
55 |
19 |
20712 |
461.6 |
-3.2 |
0.357 |
6 |
1 |
0 |
0.000 |
5 |
|
A |
44 |
14 |
20854 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
53 |
17 |
20854 |
451.1 |
-2.9 |
0.352 |
7 |
1 |
0 |
0.000 |
Average: |
456.4 |
-3.0 |
0.355 |
7 |
1 |
0 |
0.000 |
4 |
6 |
|
B |
43 |
16 |
20712 |
◊ |
A |
x-1,y+1,z |
1_465 |
44 |
13 |
20854 |
416.2 |
-5.3 |
0.136 |
2 |
0 |
0 |
0.000 |
5 |
7 |
|
B |
45 |
16 |
20712 |
◊ |
A |
x,y,z |
1_555 |
36 |
12 |
20854 |
402.9 |
-0.4 |
0.579 |
2 |
3 |
0 |
0.000 |
6 |
8 |
|
A |
43 |
16 |
20854 |
x |
A |
x,y-1,z |
1_545 |
41 |
15 |
20854 |
346.8 |
0.3 |
0.677 |
5 |
0 |
0 |
0.000 |
9 |
|
B |
37 |
13 |
20712 |
x |
B |
x,y-1,z |
1_545 |
40 |
13 |
20712 |
288.6 |
0.4 |
0.696 |
3 |
0 |
0 |
0.000 |
Average: |
317.7 |
0.3 |
0.687 |
4 |
0 |
0 |
0.000 |
7 |
10 |
|
[JHY]B:503 |
17 |
1 |
420 |
f |
B |
x,y,z |
1_555 |
44 |
19 |
20712 |
264.1 |
-5.8 |
0.409 |
3 |
0 |
0 |
0.015 |
8 |
11 |
|
[JHY]A:503 |
17 |
1 |
416 |
f |
A |
x,y,z |
1_555 |
43 |
20 |
20854 |
252.3 |
-4.9 |
0.443 |
5 |
0 |
0 |
0.015 |
9 |
12 |
|
A |
26 |
6 |
20854 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
33 |
8 |
20854 |
250.5 |
2.1 |
0.703 |
2 |
0 |
0 |
0.000 |
13 |
|
B |
23 |
6 |
20712 |
x |
B |
-x,y-1/2,-z |
2_545 |
28 |
7 |
20712 |
227.4 |
0.9 |
0.572 |
5 |
0 |
0 |
0.000 |
Average: |
238.9 |
1.5 |
0.637 |
4 |
0 |
0 |
0.000 |
10 |
14 |
|
[GOL]B:506 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
22 |
7 |
20712 |
143.6 |
-0.1 |
0.592 |
3 |
0 |
0 |
0.003 |
11 |
15 |
|
B |
16 |
6 |
20712 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
7 |
20854 |
140.4 |
-1.5 |
0.338 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
[GOL]A:505 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
20854 |
138.3 |
-0.9 |
0.460 |
4 |
0 |
0 |
0.006 |
13 |
17 |
|
[GOL]B:507 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
22 |
8 |
20712 |
132.7 |
-0.1 |
0.574 |
4 |
0 |
0 |
0.005 |
18 |
|
[GOL]A:507 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
22 |
8 |
20854 |
132.2 |
-0.1 |
0.607 |
5 |
0 |
0 |
0.005 |
Average: |
132.4 |
-0.1 |
0.590 |
5 |
0 |
0 |
0.005 |
14 |
19 |
|
[GOL]A:506 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
26 |
9 |
20854 |
132.5 |
-0.4 |
0.578 |
1 |
0 |
0 |
0.002 |
15 |
20 |
|
[GOL]B:504 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
20712 |
131.6 |
-0.5 |
0.472 |
3 |
0 |
0 |
0.004 |
21 |
|
[GOL]A:504 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
20854 |
127.7 |
-0.7 |
0.468 |
2 |
0 |
0 |
0.004 |
Average: |
129.6 |
-0.6 |
0.470 |
3 |
0 |
0 |
0.004 |
16 |
22 |
|
[GOL]B:505 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
20 |
10 |
20712 |
128.3 |
-0.9 |
0.452 |
4 |
0 |
0 |
0.006 |
17 |
23 |
|
[GOL]A:504 |
5 |
1 |
219 |
f |
[FAD]A:501 |
x,y,z |
1_555 |
9 |
1 |
1008 |
62.7 |
-2.6 |
0.397 |
2 |
0 |
0 |
0.008 |
24 |
|
[GOL]B:504 |
6 |
1 |
219 |
f |
[FAD]B:501 |
x,y,z |
1_555 |
8 |
1 |
1002 |
60.7 |
-2.4 |
0.362 |
3 |
0 |
0 |
0.008 |
Average: |
61.7 |
-2.5 |
0.380 |
3 |
0 |
0 |
0.008 |
18 |
25 |
|
[CL]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
20712 |
54.6 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.018 |
26 |
|
[CL]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
20854 |
53.1 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.018 |
Average: |
53.9 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.018 |
19 |
27 |
|
[JHY]A:503 |
5 |
1 |
416 |
f |
[FAD]A:501 |
x,y,z |
1_555 |
8 |
1 |
1008 |
51.9 |
-2.3 |
0.562 |
0 |
0 |
0 |
0.005 |
20 |
28 |
|
[JHY]B:503 |
5 |
1 |
420 |
f |
[FAD]B:501 |
x,y,z |
1_555 |
9 |
1 |
1002 |
51.7 |
-2.0 |
0.564 |
0 |
0 |
0 |
0.004 |
21 |
29 |
|
[CL]B:502 |
1 |
1 |
125 |
f |
[FAD]B:501 |
x,y,z |
1_555 |
10 |
1 |
1002 |
36.5 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.008 |
30 |
|
[CL]A:502 |
1 |
1 |
125 |
f |
[FAD]A:501 |
x,y,z |
1_555 |
12 |
1 |
1008 |
36.4 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.008 |
Average: |
36.5 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.008 |
22 |
31 |
|
[GOL]B:505 |
2 |
1 |
218 |
f |
[FAD]B:501 |
x,y,z |
1_555 |
3 |
1 |
1002 |
32.3 |
-0.5 |
0.434 |
0 |
0 |
0 |
0.001 |
23 |
32 |
|
[GOL]A:505 |
2 |
1 |
221 |
f |
[FAD]A:501 |
x,y,z |
1_555 |
2 |
1 |
1008 |
31.8 |
-0.6 |
0.306 |
0 |
0 |
0 |
0.001 |
24 |
33 |
|
[GOL]A:506 |
2 |
1 |
219 |
f |
[JHY]A:503 |
x,y,z |
1_555 |
3 |
1 |
416 |
20.1 |
0.4 |
0.509 |
1 |
0 |
0 |
0.000 |
25 |
34 |
|
[GOL]B:506 |
1 |
1 |
220 |
f |
[JHY]B:503 |
x,y,z |
1_555 |
3 |
1 |
420 |
16.8 |
0.3 |
0.414 |
1 |
0 |
0 |
0.000 |
26 |
35 |
|
[JHY]A:503 |
3 |
1 |
416 |
f |
[CL]A:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
5.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.001 |
36 |
|
[JHY]B:503 |
2 |
1 |
420 |
f |
[CL]B:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
2.0 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.001 |
Average: |
3.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.001 |
|