## |
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 |
162 |
42 |
9945 |
◊ |
A |
x,y,z |
1_555 |
161 |
43 |
10186 |
1461.2 |
-22.1 |
0.031 |
17 |
0 |
0 |
0.432 |
2 |
|
B |
150 |
42 |
10228 |
◊ |
B |
x,-y,-z |
4_555 |
150 |
42 |
10228 |
1447.9 |
-21.2 |
0.024 |
17 |
0 |
0 |
0.432 |
3 |
|
F |
155 |
42 |
10068 |
◊ |
F |
x,-y,-z |
4_555 |
155 |
42 |
10068 |
1434.8 |
-22.5 |
0.024 |
15 |
0 |
0 |
0.432 |
4 |
|
E |
153 |
42 |
9977 |
◊ |
C |
x,y,z |
1_555 |
151 |
41 |
9820 |
1428.2 |
-22.7 |
0.019 |
17 |
0 |
0 |
0.432 |
Average: |
1443.0 |
-22.1 |
0.024 |
17 |
0 |
0 |
0.432 |
2 |
5 |
|
F |
64 |
19 |
10068 |
◊ |
E |
x,y,z |
1_555 |
65 |
23 |
9977 |
603.8 |
-5.0 |
0.227 |
7 |
5 |
0 |
0.270 |
6 |
|
C |
64 |
23 |
9820 |
◊ |
B |
x,y,z |
1_555 |
64 |
19 |
10228 |
581.7 |
-6.1 |
0.172 |
7 |
5 |
0 |
0.270 |
7 |
|
F |
65 |
22 |
10068 |
◊ |
A |
x,y,z |
1_555 |
63 |
18 |
10186 |
559.1 |
-4.4 |
0.245 |
7 |
6 |
0 |
0.270 |
8 |
|
E |
62 |
17 |
9977 |
◊ |
A |
x,y,z |
1_555 |
61 |
22 |
10186 |
543.9 |
-6.6 |
0.183 |
6 |
5 |
0 |
0.270 |
9 |
|
D |
60 |
22 |
9945 |
◊ |
C |
x,-y,-z |
4_555 |
59 |
17 |
9820 |
543.5 |
-6.1 |
0.198 |
6 |
5 |
0 |
0.270 |
10 |
|
D |
60 |
17 |
9945 |
◊ |
B |
x,-y,-z |
4_555 |
63 |
22 |
10228 |
536.4 |
-7.2 |
0.158 |
6 |
6 |
0 |
0.270 |
Average: |
561.4 |
-5.9 |
0.197 |
7 |
5 |
0 |
0.270 |
3 |
11 |
|
F |
60 |
18 |
10068 |
◊ |
C |
x,y,z |
1_555 |
53 |
16 |
9820 |
482.2 |
2.4 |
0.894 |
10 |
3 |
0 |
0.085 |
12 |
|
F |
56 |
16 |
10068 |
◊ |
A |
x,-y,-z |
4_555 |
56 |
18 |
10186 |
453.0 |
2.3 |
0.886 |
9 |
2 |
0 |
0.085 |
13 |
|
E |
57 |
15 |
9977 |
◊ |
B |
x,y,z |
1_555 |
61 |
17 |
10228 |
446.8 |
0.4 |
0.764 |
6 |
2 |
0 |
0.085 |
14 |
|
E |
60 |
18 |
9977 |
◊ |
D |
x,y,z |
1_555 |
53 |
15 |
9945 |
444.9 |
0.9 |
0.817 |
8 |
2 |
0 |
0.085 |
15 |
|
C |
61 |
19 |
9820 |
◊ |
A |
x,-y,-z |
4_555 |
59 |
16 |
10186 |
432.3 |
1.3 |
0.841 |
8 |
2 |
0 |
0.085 |
16 |
|
D |
49 |
17 |
9945 |
◊ |
B |
x,y,z |
1_555 |
51 |
16 |
10228 |
410.4 |
0.8 |
0.791 |
6 |
2 |
0 |
0.085 |
Average: |
444.9 |
1.3 |
0.832 |
8 |
2 |
0 |
0.085 |
4 |
17 |
|
[FMN]F:301 |
27 |
1 |
636 |
f |
F |
x,y,z |
1_555 |
43 |
18 |
10068 |
295.3 |
-4.6 |
0.601 |
12 |
0 |
0 |
0.341 |
18 |
|
[FMN]A:301 |
27 |
1 |
638 |
f |
A |
x,y,z |
1_555 |
40 |
17 |
10186 |
294.9 |
-4.6 |
0.580 |
13 |
0 |
0 |
0.341 |
19 |
|
[FMN]D:301 |
27 |
1 |
635 |
f |
D |
x,y,z |
1_555 |
35 |
17 |
9945 |
291.6 |
-4.8 |
0.551 |
12 |
0 |
0 |
0.341 |
20 |
|
[FMN]B:301 |
27 |
1 |
636 |
f |
B |
x,y,z |
1_555 |
39 |
17 |
10228 |
290.6 |
-4.8 |
0.534 |
12 |
0 |
0 |
0.341 |
21 |
|
[FMN]C:301 |
27 |
1 |
636 |
f |
C |
x,y,z |
1_555 |
38 |
17 |
9820 |
288.7 |
-5.1 |
0.510 |
12 |
0 |
0 |
0.341 |
22 |
|
[FMN]E:301 |
27 |
1 |
636 |
f |
E |
x,y,z |
1_555 |
39 |
17 |
9977 |
285.1 |
-4.5 |
0.582 |
12 |
0 |
0 |
0.341 |
Average: |
291.0 |
-4.7 |
0.560 |
12 |
0 |
0 |
0.341 |
5 |
23 |
|
A |
31 |
9 |
10186 |
◊ |
B |
x-1/2,-y-1/2,-z |
8_445 |
36 |
10 |
10228 |
293.3 |
0.7 |
0.688 |
4 |
1 |
0 |
0.000 |
6 |
24 |
|
C |
22 |
6 |
9820 |
◊ |
B |
-x,y,-z-1/2 |
3_554 |
14 |
6 |
10228 |
188.0 |
-0.9 |
0.430 |
4 |
0 |
0 |
0.000 |
7 |
25 |
|
F |
29 |
11 |
10068 |
◊ |
D |
x-1/2,-y-1/2,-z |
8_445 |
20 |
8 |
9945 |
185.8 |
-1.6 |
0.457 |
0 |
0 |
0 |
0.000 |
8 |
26 |
|
E |
18 |
10 |
9977 |
◊ |
D |
x-1/2,-y-1/2,-z |
8_445 |
18 |
5 |
9945 |
165.1 |
-0.6 |
0.585 |
0 |
1 |
0 |
0.000 |
9 |
27 |
|
[FMN]C:301 |
25 |
1 |
636 |
◊ |
B |
x,y,z |
1_555 |
30 |
6 |
10228 |
161.9 |
-0.5 |
0.751 |
3 |
0 |
0 |
0.044 |
28 |
|
[FMN]E:301 |
25 |
1 |
636 |
◊ |
F |
x,y,z |
1_555 |
31 |
6 |
10068 |
159.4 |
-0.4 |
0.776 |
3 |
0 |
0 |
0.044 |
29 |
|
[FMN]D:301 |
23 |
1 |
635 |
◊ |
C |
x,-y,-z |
4_555 |
28 |
5 |
9820 |
150.4 |
-0.2 |
0.784 |
3 |
0 |
0 |
0.044 |
30 |
|
[FMN]A:301 |
24 |
1 |
638 |
◊ |
E |
x,y,z |
1_555 |
28 |
5 |
9977 |
148.1 |
-0.2 |
0.782 |
3 |
0 |
0 |
0.044 |
31 |
|
[FMN]B:301 |
24 |
1 |
636 |
◊ |
D |
x,-y,-z |
4_555 |
28 |
5 |
9945 |
147.7 |
-0.1 |
0.785 |
3 |
0 |
0 |
0.044 |
32 |
|
[FMN]F:301 |
24 |
1 |
636 |
◊ |
A |
x,y,z |
1_555 |
28 |
5 |
10186 |
147.3 |
-0.2 |
0.775 |
3 |
0 |
0 |
0.044 |
Average: |
152.5 |
-0.3 |
0.775 |
3 |
0 |
0 |
0.044 |
10 |
33 |
|
[FMN]E:301 |
15 |
1 |
636 |
◊ |
C |
x,y,z |
1_555 |
13 |
3 |
9820 |
94.7 |
-0.7 |
0.443 |
0 |
0 |
0 |
0.016 |
34 |
|
[FMN]B:301 |
15 |
1 |
636 |
◊ |
B |
x,-y,-z |
4_555 |
15 |
4 |
10228 |
92.1 |
-0.6 |
0.462 |
0 |
0 |
0 |
0.016 |
35 |
|
[FMN]A:301 |
15 |
1 |
638 |
◊ |
D |
x,y,z |
1_555 |
14 |
4 |
9945 |
89.1 |
-0.5 |
0.460 |
0 |
0 |
0 |
0.016 |
36 |
|
[FMN]F:301 |
15 |
1 |
636 |
◊ |
F |
x,-y,-z |
4_555 |
14 |
4 |
10068 |
88.1 |
-0.4 |
0.471 |
0 |
0 |
0 |
0.016 |
37 |
|
[FMN]D:301 |
15 |
1 |
635 |
◊ |
A |
x,y,z |
1_555 |
13 |
3 |
10186 |
84.0 |
-0.3 |
0.462 |
0 |
0 |
0 |
0.016 |
38 |
|
[FMN]C:301 |
15 |
1 |
636 |
◊ |
E |
x,y,z |
1_555 |
13 |
3 |
9977 |
82.4 |
-0.4 |
0.464 |
0 |
0 |
0 |
0.016 |
Average: |
88.4 |
-0.5 |
0.460 |
0 |
0 |
0 |
0.016 |
11 |
39 |
|
A |
11 |
6 |
10186 |
◊ |
E |
x-1/2,-y-1/2,-z |
8_445 |
16 |
8 |
9977 |
78.0 |
-0.3 |
0.541 |
0 |
0 |
0 |
0.000 |
12 |
40 |
|
[SO4]C:302 |
5 |
1 |
188 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
9820 |
60.6 |
-6.5 |
0.924 |
4 |
0 |
0 |
0.092 |
13 |
41 |
|
[SO4]A:303 |
5 |
1 |
189 |
◊ |
F |
x,-y,-z |
4_555 |
9 |
4 |
10068 |
58.3 |
-6.6 |
0.919 |
4 |
0 |
0 |
0.093 |
14 |
42 |
|
[SO4]E:302 |
5 |
1 |
188 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
9945 |
58.3 |
-6.4 |
0.918 |
4 |
0 |
0 |
0.090 |
15 |
43 |
|
[SO4]B:302 |
5 |
1 |
189 |
◊ |
B |
x,-y,-z |
4_555 |
10 |
4 |
10228 |
58.0 |
-6.6 |
0.911 |
4 |
0 |
0 |
0.092 |
16 |
44 |
|
[SO4]A:302 |
5 |
1 |
189 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
10186 |
57.9 |
-6.7 |
0.922 |
4 |
0 |
0 |
0.094 |
17 |
45 |
|
[SO4]B:303 |
5 |
1 |
188 |
◊ |
E |
x,y,z |
1_555 |
10 |
4 |
9977 |
57.1 |
-6.4 |
0.918 |
4 |
0 |
0 |
0.090 |
18 |
46 |
|
[SO4]A:302 |
5 |
1 |
189 |
f |
C |
x,-y,-z |
4_555 |
12 |
6 |
9820 |
57.0 |
-7.2 |
0.882 |
5 |
0 |
0 |
0.132 |
19 |
47 |
|
[SO4]B:302 |
5 |
1 |
189 |
f |
D |
x,-y,-z |
4_555 |
11 |
6 |
9945 |
56.5 |
-7.1 |
0.885 |
4 |
0 |
0 |
0.130 |
20 |
48 |
|
[SO4]B:303 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
10228 |
56.1 |
-7.2 |
0.879 |
6 |
0 |
0 |
0.283 |
21 |
49 |
|
[SO4]C:302 |
5 |
1 |
188 |
f |
F |
x,y,z |
1_555 |
12 |
6 |
10068 |
55.7 |
-7.1 |
0.885 |
4 |
0 |
0 |
0.263 |
22 |
50 |
|
[SO4]E:302 |
5 |
1 |
188 |
f |
E |
x,y,z |
1_555 |
13 |
7 |
9977 |
55.6 |
-7.2 |
0.881 |
7 |
0 |
0 |
0.145 |
23 |
51 |
|
[SO4]A:303 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
10186 |
55.5 |
-7.0 |
0.881 |
4 |
0 |
0 |
0.128 |
24 |
52 |
|
[SO4]A:303 |
4 |
1 |
189 |
◊ |
F |
x,y,z |
1_555 |
7 |
3 |
10068 |
39.6 |
-3.8 |
0.950 |
2 |
0 |
0 |
0.043 |
25 |
53 |
|
[SO4]E:302 |
4 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
10186 |
39.1 |
-4.1 |
0.925 |
2 |
0 |
0 |
0.046 |
26 |
54 |
|
[SO4]B:303 |
4 |
1 |
188 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
9820 |
39.1 |
-4.1 |
0.922 |
1 |
0 |
0 |
0.041 |
27 |
55 |
|
[SO4]A:302 |
5 |
1 |
189 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
9945 |
39.1 |
-3.8 |
0.957 |
1 |
0 |
0 |
0.038 |
28 |
56 |
|
[SO4]C:302 |
4 |
1 |
188 |
◊ |
E |
x,y,z |
1_555 |
7 |
3 |
9977 |
38.9 |
-3.7 |
0.950 |
2 |
0 |
0 |
0.042 |
29 |
57 |
|
[SO4]B:302 |
4 |
1 |
189 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
10228 |
38.0 |
-4.0 |
0.921 |
2 |
0 |
0 |
0.043 |
30 |
58 |
|
F |
5 |
2 |
10068 |
◊ |
E |
x-1/2,y+1/2,z |
5_455 |
6 |
2 |
9977 |
31.8 |
0.3 |
0.719 |
0 |
0 |
0 |
0.000 |
31 |
59 |
|
E |
3 |
1 |
9977 |
◊ |
B |
x-1/2,-y-1/2,-z |
8_445 |
3 |
1 |
10228 |
23.9 |
-0.2 |
0.479 |
0 |
0 |
0 |
0.000 |
32 |
60 |
|
[SO4]B:302 |
3 |
1 |
189 |
◊ |
[FMN]B:301 |
x,y,z |
1_555 |
8 |
1 |
636 |
18.9 |
-1.5 |
0.888 |
0 |
0 |
0 |
0.013 |
33 |
61 |
|
[SO4]C:302 |
3 |
1 |
188 |
◊ |
[FMN]E:301 |
x,y,z |
1_555 |
8 |
1 |
636 |
18.9 |
-1.6 |
0.887 |
0 |
0 |
0 |
0.014 |
34 |
62 |
|
[SO4]A:303 |
3 |
1 |
189 |
◊ |
[FMN]F:301 |
x,y,z |
1_555 |
8 |
1 |
636 |
18.5 |
-1.6 |
0.890 |
0 |
0 |
0 |
0.015 |
35 |
63 |
|
[SO4]B:303 |
3 |
1 |
188 |
◊ |
[FMN]C:301 |
x,y,z |
1_555 |
8 |
1 |
636 |
17.5 |
-1.5 |
0.886 |
0 |
0 |
0 |
0.013 |
36 |
64 |
|
[SO4]A:302 |
3 |
1 |
189 |
◊ |
[FMN]D:301 |
x,y,z |
1_555 |
8 |
1 |
635 |
17.0 |
-1.5 |
0.884 |
0 |
0 |
0 |
0.013 |
37 |
65 |
|
[SO4]E:302 |
3 |
1 |
188 |
◊ |
[FMN]A:301 |
x,y,z |
1_555 |
8 |
1 |
638 |
16.2 |
-1.4 |
0.888 |
0 |
0 |
0 |
0.012 |
|