## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
358 |
88 |
16360 |
◊ |
A |
x,y,z |
1_555 |
383 |
109 |
39691 |
3548.3 |
-25.5 |
0.220 |
46 |
22 |
0 |
0.231 |
2 |
|
C |
221 |
56 |
10012 |
◊ |
A |
x,y,z |
1_555 |
225 |
63 |
39691 |
2198.9 |
-8.6 |
0.570 |
33 |
16 |
0 |
0.163 |
3 |
|
A |
130 |
48 |
39691 |
◊ |
A |
-y+1,-x+1,-z+1/6 |
10_665 |
129 |
48 |
39691 |
1199.6 |
-15.4 |
0.058 |
4 |
0 |
0 |
0.084 |
4 |
|
D |
114 |
27 |
6327 |
◊ |
B |
x,y,z |
1_555 |
112 |
33 |
16360 |
1040.1 |
-7.4 |
0.286 |
13 |
3 |
0 |
0.180 |
5 |
|
D |
102 |
27 |
6327 |
◊ |
A |
x,y,z |
1_555 |
108 |
31 |
39691 |
976.6 |
-1.1 |
0.603 |
14 |
4 |
0 |
0.031 |
6 |
|
[FAD]B:405 |
52 |
1 |
1005 |
f |
B |
x,y,z |
1_555 |
114 |
48 |
16360 |
716.7 |
-7.7 |
0.474 |
18 |
0 |
0 |
0.208 |
7 |
|
C |
80 |
27 |
10012 |
◊ |
C |
x,x-y+1,-z-1/6 |
12_564 |
80 |
27 |
10012 |
702.2 |
-3.8 |
0.580 |
6 |
2 |
0 |
0.000 |
8 |
|
[NAD]A:965 |
43 |
1 |
852 |
f |
A |
x,y,z |
1_555 |
90 |
37 |
39691 |
604.8 |
-5.9 |
0.445 |
9 |
0 |
0 |
0.097 |
9 |
|
A |
61 |
22 |
39691 |
◊ |
A |
-x,-x+y,-z+1/3 |
9_555 |
62 |
22 |
39691 |
577.4 |
-3.8 |
0.399 |
6 |
0 |
0 |
0.011 |
10 |
|
D |
40 |
12 |
6327 |
◊ |
C |
x,y,z |
1_555 |
46 |
14 |
10012 |
405.0 |
-1.1 |
0.527 |
5 |
5 |
0 |
0.013 |
11 |
|
[FMN]B:406 |
29 |
1 |
602 |
cf |
B |
x,y,z |
1_555 |
47 |
20 |
16360 |
333.4 |
-3.0 |
0.650 |
7 |
0 |
0 |
0.080 |
12 |
|
C |
25 |
9 |
10012 |
◊ |
A |
-x,-x+y,-z+1/3 |
9_555 |
24 |
8 |
39691 |
228.4 |
-2.1 |
0.377 |
0 |
0 |
0 |
0.007 |
13 |
|
A |
23 |
7 |
39691 |
◊ |
B |
x-y,x,z-1/6 |
6_554 |
28 |
10 |
16360 |
223.3 |
0.5 |
0.629 |
3 |
1 |
0 |
0.000 |
14 |
|
[FMN]B:406 |
19 |
1 |
602 |
◊ |
A |
x,y,z |
1_555 |
23 |
8 |
39691 |
197.1 |
-3.4 |
0.523 |
7 |
0 |
0 |
0.031 |
15 |
|
B |
20 |
7 |
16360 |
◊ |
A |
-x,-x+y,-z+1/3 |
9_555 |
21 |
8 |
39691 |
172.6 |
1.0 |
0.794 |
4 |
1 |
0 |
0.003 |
16 |
|
B |
12 |
4 |
16360 |
◊ |
B |
-x+y,y,-z+1/2 |
11_555 |
12 |
4 |
16360 |
138.2 |
-3.1 |
0.091 |
0 |
0 |
0 |
0.000 |
17 |
|
[PYC]B:801 |
8 |
1 |
243 |
f |
B |
x,y,z |
1_555 |
23 |
12 |
16360 |
125.1 |
4.4 |
0.516 |
4 |
0 |
0 |
0.000 |
18 |
|
D |
12 |
4 |
6327 |
◊ |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
15 |
5 |
39691 |
121.0 |
-0.5 |
0.516 |
1 |
0 |
0 |
0.000 |
19 |
|
[SO4]A:2500 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
10 |
39691 |
115.5 |
-17.6 |
0.570 |
3 |
0 |
0 |
0.185 |
20 |
|
A |
15 |
6 |
39691 |
◊ |
A |
-x+y,y,-z+1/2 |
11_555 |
15 |
6 |
39691 |
115.2 |
-1.6 |
0.328 |
0 |
4 |
0 |
0.000 |
21 |
|
[SO4]A:2509 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
39691 |
109.4 |
-16.6 |
0.723 |
4 |
0 |
0 |
0.180 |
22 |
|
[SO4]A:2501 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
39691 |
100.3 |
-15.0 |
0.569 |
2 |
0 |
0 |
0.156 |
23 |
|
[SO4]B:2511 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
16360 |
95.7 |
-12.1 |
0.659 |
3 |
0 |
0 |
0.177 |
24 |
|
[SO4]C:2508 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
10012 |
95.4 |
-13.5 |
0.886 |
4 |
0 |
0 |
0.097 |
25 |
|
C |
8 |
2 |
10012 |
◊ |
B |
x-y,x,z-1/6 |
6_554 |
14 |
7 |
16360 |
89.7 |
-0.9 |
0.434 |
0 |
0 |
0 |
0.000 |
26 |
|
[SO4]B:2510 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
16360 |
83.4 |
-11.9 |
0.804 |
3 |
0 |
0 |
0.174 |
27 |
|
A |
14 |
5 |
39691 |
x |
A |
x-y,x,z-1/6 |
6_554 |
10 |
3 |
39691 |
80.5 |
-0.6 |
0.508 |
0 |
0 |
0 |
0.000 |
28 |
|
[SO4]A:2504 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
39691 |
75.3 |
-9.2 |
0.960 |
3 |
0 |
0 |
0.103 |
29 |
|
[SO4]A:2507 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
39691 |
72.9 |
-9.5 |
0.926 |
3 |
0 |
0 |
0.106 |
30 |
|
[SO4]B:2505 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
16360 |
69.7 |
-9.5 |
0.830 |
2 |
0 |
0 |
0.138 |
31 |
|
[SO4]A:2502 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
39691 |
65.1 |
-8.8 |
0.728 |
1 |
0 |
0 |
0.090 |
32 |
|
[PYC]B:801 |
8 |
1 |
243 |
f |
[FAD]B:405 |
x,y,z |
1_555 |
11 |
1 |
1005 |
59.2 |
1.9 |
0.835 |
0 |
0 |
0 |
0.000 |
33 |
|
[SO4]A:2506 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
10012 |
58.1 |
-7.6 |
0.765 |
1 |
0 |
0 |
0.051 |
34 |
|
[SO4]D:2503 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
10 |
3 |
6327 |
55.9 |
-6.9 |
0.835 |
2 |
0 |
0 |
0.103 |
35 |
|
[SO4]A:2506 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
39691 |
48.4 |
-4.5 |
0.976 |
2 |
0 |
0 |
0.034 |
36 |
|
[SO4]C:2508 |
4 |
1 |
186 |
◊ |
A |
-x,-x+y,-z+1/3 |
9_555 |
5 |
2 |
39691 |
42.1 |
-4.3 |
0.927 |
1 |
0 |
0 |
0.016 |
37 |
|
[SO4]B:2511 |
2 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
5 |
5 |
39691 |
41.7 |
-5.5 |
0.787 |
1 |
0 |
0 |
0.028 |
38 |
|
[SO4]A:2509 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
10012 |
40.5 |
-3.0 |
0.986 |
2 |
0 |
0 |
0.024 |
39 |
|
[SO4]A:2504 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
10012 |
40.4 |
-5.0 |
0.489 |
0 |
0 |
0 |
0.032 |
40 |
|
[SO4]B:2510 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
39691 |
14.2 |
-1.5 |
0.850 |
0 |
0 |
0 |
0.007 |
41 |
|
B |
3 |
1 |
16360 |
◊ |
B |
-y+1,-x+1,-z+1/6 |
10_665 |
3 |
1 |
16360 |
12.6 |
-0.4 |
0.384 |
0 |
0 |
0 |
0.000 |
42 |
|
[SO4]B:2505 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
39691 |
12.1 |
-1.6 |
0.589 |
0 |
0 |
0 |
0.007 |
43 |
|
B |
2 |
2 |
16360 |
◊ |
B |
-x,-x+y,-z+1/3 |
9_555 |
2 |
2 |
16360 |
9.0 |
0.0 |
0.659 |
0 |
0 |
0 |
0.000 |
44 |
|
C |
1 |
1 |
10012 |
◊ |
A |
x,x-y+1,-z-1/6 |
12_564 |
1 |
1 |
39691 |
1.3 |
0.0 |
0.597 |
0 |
0 |
0 |
0.000 |
45 |
|
[ZN]D:100 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
2 |
1 |
10012 |
0.8 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.002 |
|