| ## |
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 |
341 |
96 |
22820 |
◊ |
C |
x,y,z |
1_555 |
346 |
93 |
23078 |
3304.2 |
-29.2 |
0.034 |
50 |
10 |
0 |
0.449 |
2 |
|
B |
340 |
92 |
22434 |
◊ |
A |
x,y,z |
1_555 |
337 |
92 |
23864 |
3251.7 |
-28.0 |
0.052 |
52 |
10 |
0 |
0.449 |
| Average: |
3278.0 |
-28.6 |
0.043 |
51 |
10 |
0 |
0.449 |
| 2 |
3 |
|
[FAD]B:999 |
50 |
1 |
968 |
f |
B |
x,y,z |
1_555 |
102 |
40 |
22434 |
677.0 |
-10.0 |
0.363 |
23 |
0 |
0 |
0.339 |
4 |
|
[FAD]C:999 |
52 |
1 |
970 |
f |
C |
x,y,z |
1_555 |
102 |
40 |
23078 |
676.3 |
-9.9 |
0.377 |
22 |
0 |
0 |
0.339 |
5 |
|
[FAD]A:999 |
51 |
1 |
970 |
f |
A |
x,y,z |
1_555 |
100 |
38 |
23864 |
673.8 |
-9.8 |
0.413 |
22 |
0 |
0 |
0.339 |
6 |
|
[FAD]D:999 |
53 |
1 |
967 |
f |
D |
x,y,z |
1_555 |
96 |
39 |
22820 |
672.3 |
-9.8 |
0.364 |
23 |
0 |
0 |
0.339 |
| Average: |
674.8 |
-9.9 |
0.379 |
23 |
0 |
0 |
0.339 |
| 3 |
7 |
|
D |
76 |
25 |
22820 |
◊ |
A |
x,y,z |
1_555 |
64 |
20 |
23864 |
635.2 |
-0.6 |
0.641 |
4 |
1 |
0 |
0.000 |
8 |
|
B |
41 |
12 |
22434 |
◊ |
C |
x,y-1,z+1 |
1_546 |
52 |
17 |
23078 |
458.5 |
6.2 |
0.964 |
10 |
8 |
0 |
0.000 |
| Average: |
546.8 |
2.8 |
0.803 |
7 |
5 |
0 |
0.000 |
| 4 |
9 |
|
A |
72 |
19 |
23864 |
◊ |
D |
x,y-1,z |
1_545 |
62 |
20 |
22820 |
562.4 |
-0.1 |
0.619 |
12 |
4 |
0 |
0.000 |
| 5 |
10 |
|
C |
44 |
14 |
23078 |
◊ |
B |
x,y,z-1 |
1_554 |
51 |
13 |
22434 |
467.5 |
-2.8 |
0.271 |
8 |
1 |
0 |
0.000 |
| 6 |
11 |
|
C |
51 |
17 |
23078 |
◊ |
A |
x,y,z |
1_555 |
44 |
12 |
23864 |
443.6 |
-0.3 |
0.652 |
3 |
1 |
0 |
0.000 |
| 7 |
12 |
|
[FYC]B:888 |
24 |
1 |
539 |
f |
B |
x,y,z |
1_555 |
61 |
23 |
22434 |
369.3 |
2.6 |
0.339 |
3 |
0 |
0 |
0.000 |
| 8 |
13 |
|
C |
36 |
9 |
23078 |
x |
C |
x-1,y,z |
1_455 |
42 |
14 |
23078 |
368.7 |
-1.2 |
0.516 |
3 |
0 |
0 |
0.000 |
14 |
|
B |
22 |
8 |
22434 |
x |
B |
x-1,y,z |
1_455 |
36 |
10 |
22434 |
261.6 |
2.1 |
0.834 |
4 |
2 |
0 |
0.000 |
| Average: |
315.1 |
0.4 |
0.675 |
4 |
1 |
0 |
0.000 |
| 9 |
15 |
|
[FYC]A:888 |
22 |
1 |
533 |
f |
A |
x,y,z |
1_555 |
59 |
22 |
23864 |
368.1 |
2.8 |
0.402 |
5 |
0 |
0 |
0.000 |
16 |
|
[FYC]D:888 |
24 |
1 |
536 |
f |
D |
x,y,z |
1_555 |
58 |
22 |
22820 |
367.3 |
2.5 |
0.339 |
4 |
0 |
0 |
0.000 |
17 |
|
[FYC]C:888 |
24 |
1 |
532 |
f |
C |
x,y,z |
1_555 |
59 |
21 |
23078 |
365.8 |
2.5 |
0.349 |
4 |
0 |
0 |
0.000 |
| Average: |
367.1 |
2.6 |
0.363 |
4 |
0 |
0 |
0.000 |
| 10 |
18 |
|
C |
32 |
13 |
23078 |
◊ |
B |
x-1,y,z-1 |
1_454 |
35 |
9 |
22434 |
299.7 |
2.3 |
0.840 |
5 |
3 |
0 |
0.000 |
| 11 |
19 |
|
A |
27 |
12 |
23864 |
x |
A |
x-1,y,z |
1_455 |
33 |
13 |
23864 |
276.6 |
-0.7 |
0.581 |
3 |
1 |
0 |
0.000 |
20 |
|
D |
27 |
8 |
22820 |
x |
D |
x-1,y,z |
1_455 |
33 |
11 |
22820 |
255.4 |
-1.9 |
0.391 |
1 |
2 |
0 |
0.000 |
| Average: |
266.0 |
-1.3 |
0.486 |
2 |
2 |
0 |
0.000 |
| 12 |
21 |
|
B |
32 |
9 |
22434 |
◊ |
D |
x,y-1,z+1 |
1_546 |
38 |
12 |
22820 |
266.0 |
0.3 |
0.654 |
3 |
1 |
0 |
0.000 |
| 13 |
22 |
|
[SO4]C:1659 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
21 |
10 |
23078 |
117.3 |
-20.2 |
0.638 |
2 |
0 |
0 |
0.165 |
| 14 |
23 |
|
[SO4]D:1659 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
21 |
10 |
22820 |
115.0 |
-19.1 |
0.670 |
2 |
0 |
0 |
0.157 |
| 15 |
24 |
|
[SO4]B:1659 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
16 |
10 |
22434 |
113.1 |
-17.3 |
0.621 |
0 |
0 |
0 |
0.147 |
| 16 |
25 |
|
[FAD]B:999 |
17 |
1 |
968 |
f |
[FYC]B:888 |
x,y,z |
1_555 |
12 |
1 |
539 |
94.5 |
2.2 |
0.518 |
0 |
0 |
0 |
0.000 |
26 |
|
[FAD]A:999 |
17 |
1 |
970 |
f |
[FYC]A:888 |
x,y,z |
1_555 |
12 |
1 |
533 |
93.5 |
2.3 |
0.533 |
0 |
0 |
0 |
0.000 |
27 |
|
[FAD]D:999 |
16 |
1 |
967 |
f |
[FYC]D:888 |
x,y,z |
1_555 |
12 |
1 |
536 |
93.1 |
2.3 |
0.537 |
0 |
0 |
0 |
0.000 |
28 |
|
[FAD]C:999 |
17 |
1 |
970 |
f |
[FYC]C:888 |
x,y,z |
1_555 |
12 |
1 |
532 |
92.4 |
2.2 |
0.528 |
0 |
0 |
0 |
0.000 |
| Average: |
93.4 |
2.3 |
0.529 |
0 |
0 |
0 |
0.000 |
| 17 |
29 |
|
C |
8 |
5 |
23078 |
◊ |
A |
x,y,z-1 |
1_554 |
11 |
5 |
23864 |
85.8 |
1.8 |
0.829 |
1 |
2 |
0 |
0.000 |
30 |
|
B |
8 |
5 |
22434 |
◊ |
D |
x,y-1,z |
1_545 |
11 |
5 |
22820 |
51.7 |
0.4 |
0.692 |
0 |
0 |
0 |
0.000 |
| Average: |
68.8 |
1.1 |
0.761 |
1 |
1 |
0 |
0.000 |
| 18 |
31 |
|
[SO4]A:1659 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
23864 |
79.8 |
-10.7 |
0.842 |
2 |
0 |
0 |
0.099 |
| 19 |
32 |
|
[SO4]A:1659 |
4 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
22434 |
25.1 |
-1.9 |
0.980 |
1 |
0 |
0 |
0.020 |
| 20 |
33 |
|
D |
2 |
2 |
22820 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
2 |
23078 |
12.5 |
0.3 |
0.603 |
0 |
0 |
0 |
0.000 |
| 21 |
34 |
|
A |
3 |
2 |
23864 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
3 |
22434 |
11.5 |
0.0 |
0.637 |
0 |
0 |
0 |
0.000 |
|