## |
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 |
84 |
26 |
16880 |
◊ |
A |
x,y,z |
1_555 |
83 |
25 |
17160 |
849.3 |
-4.9 |
0.382 |
4 |
0 |
0 |
0.069 |
2 |
|
C |
84 |
26 |
17011 |
◊ |
B |
x-1,y-1,z |
1_445 |
82 |
25 |
17001 |
848.0 |
-4.6 |
0.414 |
5 |
0 |
0 |
0.069 |
Average: |
848.7 |
-4.8 |
0.398 |
5 |
0 |
0 |
0.069 |
2 |
3 |
|
[FAD]C:389 |
52 |
1 |
1006 |
f |
C |
x,y,z |
1_555 |
96 |
40 |
17011 |
699.2 |
-5.0 |
0.627 |
12 |
0 |
0 |
0.197 |
4 |
|
[FAD]A:389 |
53 |
1 |
1000 |
f |
A |
x,y,z |
1_555 |
94 |
41 |
17160 |
698.2 |
-4.6 |
0.619 |
11 |
0 |
0 |
0.197 |
5 |
|
[FAD]B:389 |
52 |
1 |
1000 |
f |
B |
x,y,z |
1_555 |
92 |
39 |
17001 |
691.5 |
-4.6 |
0.639 |
12 |
0 |
0 |
0.197 |
6 |
|
[FAD]D:389 |
52 |
1 |
996 |
f |
D |
x,y,z |
1_555 |
89 |
37 |
16880 |
691.0 |
-4.7 |
0.642 |
11 |
0 |
0 |
0.197 |
Average: |
695.0 |
-4.7 |
0.632 |
12 |
0 |
0 |
0.197 |
3 |
7 |
|
B |
51 |
15 |
17001 |
◊ |
A |
x,y,z |
1_555 |
38 |
13 |
17160 |
439.4 |
-7.1 |
0.078 |
0 |
0 |
0 |
0.000 |
4 |
8 |
|
D |
39 |
11 |
16880 |
◊ |
B |
x,y-1,z-1 |
1_544 |
41 |
12 |
17001 |
379.7 |
-4.2 |
0.251 |
3 |
0 |
0 |
0.000 |
9 |
|
A |
41 |
12 |
17160 |
◊ |
C |
x,y,z-1 |
1_554 |
40 |
11 |
17011 |
377.5 |
-3.6 |
0.290 |
4 |
1 |
0 |
0.000 |
Average: |
378.6 |
-3.9 |
0.270 |
4 |
1 |
0 |
0.000 |
5 |
10 |
|
D |
23 |
7 |
16880 |
◊ |
C |
x,y,z |
1_555 |
22 |
6 |
17011 |
203.7 |
1.6 |
0.825 |
1 |
0 |
0 |
0.000 |
11 |
|
C |
21 |
6 |
17011 |
◊ |
D |
x-1,y,z |
1_455 |
19 |
6 |
16880 |
181.0 |
1.4 |
0.813 |
0 |
0 |
0 |
0.000 |
Average: |
192.4 |
1.5 |
0.819 |
1 |
0 |
0 |
0.000 |
6 |
12 |
|
D |
25 |
8 |
16880 |
◊ |
B |
x,y-1,z |
1_545 |
22 |
8 |
17001 |
190.7 |
-2.1 |
0.351 |
0 |
0 |
0 |
0.000 |
13 |
|
C |
25 |
7 |
17011 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
17160 |
183.5 |
-2.0 |
0.338 |
2 |
0 |
0 |
0.000 |
Average: |
187.1 |
-2.1 |
0.344 |
1 |
0 |
0 |
0.000 |
7 |
14 |
|
[SO4]B:393 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
17001 |
89.7 |
-9.7 |
0.894 |
3 |
0 |
0 |
0.097 |
8 |
15 |
|
[SO4]B:394 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
17001 |
84.4 |
-12.2 |
0.813 |
2 |
0 |
0 |
0.115 |
9 |
16 |
|
[SO4]C:393 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
8 |
3 |
17011 |
81.7 |
-8.7 |
0.900 |
2 |
0 |
0 |
0.085 |
10 |
17 |
|
[SO4]A:391 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
3 |
17160 |
79.5 |
-10.8 |
0.813 |
3 |
0 |
0 |
0.125 |
11 |
18 |
|
[SO4]D:393 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
16880 |
76.1 |
-7.9 |
0.920 |
4 |
0 |
0 |
0.100 |
12 |
19 |
|
[SO4]C:391 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
11 |
3 |
17011 |
75.8 |
-10.5 |
0.810 |
3 |
0 |
0 |
0.104 |
13 |
20 |
|
[SO4]A:393 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
17160 |
74.0 |
-7.8 |
0.870 |
2 |
0 |
0 |
0.090 |
14 |
21 |
|
[SO4]D:391 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
11 |
3 |
16880 |
73.0 |
-9.7 |
0.818 |
3 |
0 |
0 |
0.114 |
15 |
22 |
|
A |
8 |
3 |
17160 |
◊ |
B |
x-1,y,z |
1_455 |
12 |
6 |
17001 |
72.9 |
-0.3 |
0.431 |
0 |
0 |
0 |
0.000 |
16 |
23 |
|
[SO4]B:391 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
17001 |
72.6 |
-10.0 |
0.813 |
3 |
0 |
0 |
0.100 |
17 |
24 |
|
D |
4 |
3 |
16880 |
◊ |
A |
x,y-1,z |
1_545 |
9 |
4 |
17160 |
68.8 |
-1.4 |
0.121 |
0 |
0 |
0 |
0.000 |
18 |
25 |
|
[SO4]A:392 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
17160 |
67.1 |
-7.6 |
0.966 |
2 |
0 |
0 |
0.088 |
19 |
26 |
|
[SO4]B:392 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
17001 |
66.7 |
-7.7 |
0.967 |
4 |
0 |
0 |
0.083 |
20 |
27 |
|
[SO4]D:392 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
16880 |
66.5 |
-7.4 |
0.962 |
4 |
0 |
0 |
0.095 |
21 |
28 |
|
[SO4]C:392 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
17011 |
63.9 |
-7.1 |
0.959 |
4 |
0 |
0 |
0.079 |
22 |
29 |
|
C |
8 |
4 |
17011 |
◊ |
A |
x-1,y,z |
1_455 |
6 |
2 |
17160 |
50.1 |
0.5 |
0.733 |
0 |
0 |
0 |
0.000 |
30 |
|
D |
8 |
4 |
16880 |
◊ |
B |
x-1,y-1,z |
1_445 |
6 |
2 |
17001 |
45.1 |
0.5 |
0.721 |
0 |
0 |
0 |
0.000 |
Average: |
47.6 |
0.5 |
0.727 |
0 |
0 |
0 |
0.000 |
23 |
31 |
|
[SO4]A:391 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
16880 |
32.2 |
-2.8 |
0.976 |
3 |
0 |
0 |
0.043 |
24 |
32 |
|
[SO4]D:391 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
17160 |
31.8 |
-2.9 |
0.963 |
1 |
0 |
0 |
0.034 |
25 |
33 |
|
[SO4]C:391 |
4 |
1 |
185 |
◊ |
B |
x-1,y-1,z |
1_445 |
3 |
1 |
17001 |
31.6 |
-2.8 |
0.968 |
1 |
0 |
0 |
0.028 |
26 |
34 |
|
C |
3 |
1 |
17011 |
◊ |
[SO4]B:391 |
x-1,y-1,z |
1_445 |
4 |
1 |
186 |
30.4 |
-2.6 |
0.965 |
1 |
0 |
0 |
0.027 |
27 |
35 |
|
[SO4]B:393 |
4 |
1 |
186 |
f |
[FAD]B:389 |
x,y,z |
1_555 |
5 |
1 |
1000 |
23.1 |
-2.3 |
0.800 |
0 |
0 |
0 |
0.020 |
28 |
36 |
|
[SO4]C:393 |
3 |
1 |
185 |
f |
[FAD]C:389 |
x,y,z |
1_555 |
2 |
1 |
1006 |
16.3 |
-1.6 |
0.831 |
0 |
0 |
0 |
0.014 |
29 |
37 |
|
[SO4]D:393 |
1 |
1 |
186 |
f |
[FAD]D:389 |
x,y,z |
1_555 |
2 |
1 |
996 |
14.9 |
-1.4 |
0.751 |
0 |
0 |
0 |
0.015 |
30 |
38 |
|
[SO4]A:393 |
3 |
1 |
187 |
f |
[FAD]A:389 |
x,y,z |
1_555 |
3 |
1 |
1000 |
13.3 |
-1.3 |
0.793 |
0 |
0 |
0 |
0.013 |
31 |
39 |
|
C |
5 |
3 |
17011 |
x |
C |
x-1,y,z |
1_455 |
3 |
3 |
17011 |
10.3 |
0.0 |
0.630 |
0 |
0 |
0 |
0.000 |
40 |
|
D |
3 |
2 |
16880 |
x |
D |
x-1,y,z |
1_455 |
3 |
3 |
16880 |
3.8 |
-0.0 |
0.577 |
0 |
0 |
0 |
0.000 |
41 |
|
A |
2 |
2 |
17160 |
x |
A |
x-1,y,z |
1_455 |
3 |
2 |
17160 |
3.4 |
0.0 |
0.624 |
0 |
0 |
0 |
0.000 |
42 |
|
B |
1 |
1 |
17001 |
x |
B |
x-1,y,z |
1_455 |
1 |
1 |
17001 |
0.8 |
0.0 |
0.679 |
0 |
0 |
0 |
0.000 |
Average: |
4.6 |
0.0 |
0.628 |
0 |
0 |
0 |
0.000 |
32 |
43 |
|
[SO4]D:391 |
2 |
1 |
186 |
◊ |
[SO4]A:391 |
x,y,z |
1_555 |
1 |
1 |
186 |
6.6 |
-1.6 |
0.876 |
0 |
0 |
0 |
0.016 |
33 |
44 |
|
[SO4]C:391 |
1 |
1 |
185 |
◊ |
[SO4]B:391 |
x-1,y-1,z |
1_445 |
1 |
1 |
186 |
4.3 |
-1.0 |
1.000 |
0 |
0 |
0 |
0.009 |
|