## |
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 |
|
D |
344 |
95 |
23266 |
◊ |
C |
x,y,z |
1_555 |
352 |
95 |
23200 |
3276.6 |
-30.8 |
0.051 |
54 |
10 |
0 |
0.449 |
2 |
|
B |
335 |
90 |
22688 |
◊ |
A |
x,y,z |
1_555 |
334 |
91 |
23029 |
3252.4 |
-29.0 |
0.054 |
51 |
10 |
0 |
0.449 |
Average: |
3264.5 |
-29.9 |
0.053 |
53 |
10 |
0 |
0.449 |
2 |
3 |
|
[FAD]A:999 |
51 |
1 |
971 |
f |
A |
x,y,z |
1_555 |
102 |
41 |
23029 |
703.1 |
-10.5 |
0.347 |
23 |
0 |
0 |
0.325 |
4 |
|
[FAD]D:999 |
52 |
1 |
969 |
f |
D |
x,y,z |
1_555 |
101 |
41 |
23266 |
702.6 |
-10.9 |
0.349 |
22 |
0 |
0 |
0.325 |
5 |
|
[FAD]B:999 |
52 |
1 |
973 |
f |
B |
x,y,z |
1_555 |
100 |
39 |
22688 |
701.5 |
-11.1 |
0.284 |
23 |
0 |
0 |
0.325 |
6 |
|
[FAD]C:999 |
51 |
1 |
967 |
f |
C |
x,y,z |
1_555 |
105 |
41 |
23200 |
697.5 |
-10.8 |
0.372 |
21 |
0 |
0 |
0.325 |
Average: |
701.2 |
-10.8 |
0.338 |
22 |
0 |
0 |
0.325 |
3 |
7 |
|
[AWB]A:800 |
39 |
1 |
825 |
f |
A |
x,y,z |
1_555 |
84 |
30 |
23029 |
615.0 |
-4.4 |
0.191 |
3 |
0 |
0 |
0.104 |
8 |
|
[AWB]D:800 |
39 |
1 |
807 |
f |
D |
x,y,z |
1_555 |
89 |
32 |
23266 |
610.4 |
-5.5 |
0.209 |
4 |
0 |
0 |
0.104 |
9 |
|
[AWB]B:800 |
39 |
1 |
807 |
f |
B |
x,y,z |
1_555 |
88 |
31 |
22688 |
610.4 |
-4.6 |
0.222 |
4 |
0 |
0 |
0.104 |
10 |
|
[AWB]C:800 |
39 |
1 |
806 |
f |
C |
x,y,z |
1_555 |
88 |
31 |
23200 |
606.8 |
-4.9 |
0.236 |
2 |
0 |
0 |
0.104 |
Average: |
610.6 |
-4.9 |
0.214 |
3 |
0 |
0 |
0.104 |
4 |
11 |
|
A |
62 |
17 |
23029 |
◊ |
D |
x,y-1,z |
1_545 |
59 |
19 |
23266 |
528.8 |
-0.8 |
0.570 |
8 |
5 |
0 |
0.000 |
12 |
|
C |
50 |
14 |
23200 |
◊ |
B |
x,y,z-1 |
1_554 |
55 |
15 |
22688 |
491.1 |
-2.2 |
0.315 |
9 |
0 |
0 |
0.000 |
Average: |
510.0 |
-1.5 |
0.442 |
9 |
3 |
0 |
0.000 |
5 |
13 |
|
D |
40 |
15 |
23266 |
◊ |
A |
x,y,z |
1_555 |
36 |
12 |
23029 |
364.0 |
3.3 |
0.898 |
9 |
2 |
0 |
0.000 |
14 |
|
B |
37 |
11 |
22688 |
◊ |
C |
x,y-1,z+1 |
1_546 |
45 |
14 |
23200 |
356.4 |
3.0 |
0.897 |
6 |
1 |
0 |
0.000 |
Average: |
360.2 |
3.1 |
0.898 |
8 |
2 |
0 |
0.000 |
6 |
15 |
|
C |
52 |
16 |
23200 |
◊ |
A |
x,y,z |
1_555 |
36 |
10 |
23029 |
350.7 |
-1.8 |
0.506 |
2 |
3 |
0 |
0.000 |
7 |
16 |
|
C |
32 |
9 |
23200 |
x |
C |
x-1,y,z |
1_455 |
29 |
10 |
23200 |
277.4 |
-3.0 |
0.277 |
1 |
0 |
0 |
0.000 |
17 |
|
B |
18 |
8 |
22688 |
x |
B |
x-1,y,z |
1_455 |
35 |
10 |
22688 |
195.9 |
2.2 |
0.865 |
3 |
1 |
0 |
0.000 |
Average: |
236.7 |
-0.4 |
0.571 |
2 |
1 |
0 |
0.000 |
8 |
18 |
|
A |
24 |
11 |
23029 |
x |
A |
x-1,y,z |
1_455 |
30 |
11 |
23029 |
266.7 |
-0.7 |
0.567 |
2 |
1 |
0 |
0.000 |
19 |
|
D |
21 |
7 |
23266 |
x |
D |
x-1,y,z |
1_455 |
25 |
7 |
23266 |
219.4 |
-1.4 |
0.440 |
0 |
1 |
0 |
0.000 |
Average: |
243.1 |
-1.1 |
0.504 |
1 |
1 |
0 |
0.000 |
9 |
20 |
|
B |
28 |
8 |
22688 |
◊ |
D |
x,y-1,z+1 |
1_546 |
31 |
10 |
23266 |
233.4 |
0.7 |
0.726 |
3 |
1 |
0 |
0.000 |
10 |
21 |
|
C |
24 |
11 |
23200 |
◊ |
B |
x-1,y,z-1 |
1_454 |
28 |
8 |
22688 |
227.6 |
3.7 |
0.942 |
6 |
2 |
0 |
0.000 |
11 |
22 |
|
[SO4]A:1659 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
23029 |
83.5 |
-11.0 |
0.839 |
3 |
0 |
0 |
0.089 |
12 |
23 |
|
[SO4]D:1659 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
16 |
7 |
23266 |
82.9 |
-11.2 |
0.815 |
2 |
0 |
0 |
0.097 |
13 |
24 |
|
[SO4]B:1659 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
22688 |
82.6 |
-11.1 |
0.819 |
2 |
0 |
0 |
0.087 |
14 |
25 |
|
B |
11 |
5 |
22688 |
◊ |
D |
x,y-1,z |
1_545 |
6 |
5 |
23266 |
53.9 |
0.7 |
0.762 |
0 |
0 |
0 |
0.000 |
26 |
|
C |
7 |
5 |
23200 |
◊ |
A |
x,y,z-1 |
1_554 |
6 |
4 |
23029 |
37.6 |
0.0 |
0.624 |
0 |
0 |
0 |
0.000 |
Average: |
45.8 |
0.3 |
0.693 |
0 |
0 |
0 |
0.000 |
15 |
27 |
|
[SO4]D:1659 |
4 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
23200 |
28.1 |
-2.3 |
0.971 |
1 |
0 |
0 |
0.022 |
16 |
28 |
|
[SO4]A:1659 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
22688 |
27.8 |
-2.1 |
0.976 |
1 |
0 |
0 |
0.018 |
17 |
29 |
|
[SO4]B:1659 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
23029 |
26.1 |
-2.2 |
0.967 |
1 |
0 |
0 |
0.019 |
18 |
30 |
|
[FAD]A:999 |
2 |
1 |
971 |
f |
[AWB]A:800 |
x,y,z |
1_555 |
1 |
1 |
825 |
15.2 |
-0.5 |
0.312 |
0 |
0 |
0 |
0.006 |
31 |
|
[FAD]B:999 |
1 |
1 |
973 |
f |
[AWB]B:800 |
x,y,z |
1_555 |
1 |
1 |
807 |
9.2 |
-0.3 |
0.344 |
0 |
0 |
0 |
0.006 |
32 |
|
[FAD]C:999 |
1 |
1 |
967 |
f |
[AWB]C:800 |
x,y,z |
1_555 |
1 |
1 |
806 |
8.6 |
-0.3 |
0.379 |
0 |
0 |
0 |
0.006 |
33 |
|
[FAD]D:999 |
1 |
1 |
969 |
f |
[AWB]D:800 |
x,y,z |
1_555 |
2 |
1 |
807 |
7.4 |
-0.1 |
0.421 |
0 |
0 |
0 |
0.006 |
Average: |
10.1 |
-0.3 |
0.364 |
0 |
0 |
0 |
0.006 |
19 |
34 |
|
A |
1 |
1 |
23029 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
22688 |
3.7 |
0.1 |
0.687 |
0 |
0 |
0 |
0.000 |
20 |
35 |
|
D |
1 |
1 |
23266 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
23200 |
2.3 |
0.1 |
0.661 |
0 |
0 |
0 |
0.000 |
|