## |
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 |
|
B |
92 |
25 |
15659 |
◊ |
A |
x,-y+2,-z+2 |
4_577 |
78 |
28 |
15669 |
801.7 |
-5.7 |
0.220 |
7 |
4 |
0 |
0.000 |
2 |
|
B |
71 |
28 |
15659 |
◊ |
A |
x-1/2,-y+3/2,-z+2 |
8_467 |
87 |
24 |
15669 |
770.6 |
-4.8 |
0.263 |
5 |
4 |
0 |
0.000 |
Average: |
786.1 |
-5.3 |
0.242 |
6 |
4 |
0 |
0.000 |
2 |
3 |
|
[FAD]B:601 |
50 |
1 |
905 |
f |
B |
x,y,z |
1_555 |
84 |
29 |
15659 |
566.8 |
-7.3 |
0.408 |
20 |
0 |
0 |
0.028 |
4 |
|
[FAD]A:501 |
50 |
1 |
899 |
f |
A |
x,y,z |
1_555 |
86 |
29 |
15669 |
561.2 |
-7.3 |
0.444 |
21 |
0 |
0 |
0.028 |
Average: |
564.0 |
-7.3 |
0.426 |
21 |
0 |
0 |
0.028 |
3 |
5 |
|
B |
47 |
13 |
15659 |
◊ |
B |
-x+1,y,-z+5/2 |
3_657 |
48 |
13 |
15659 |
442.6 |
-2.7 |
0.340 |
6 |
0 |
0 |
0.000 |
6 |
|
A |
49 |
14 |
15669 |
◊ |
A |
x,-y+2,-z+2 |
4_577 |
49 |
14 |
15669 |
430.9 |
-3.4 |
0.280 |
6 |
0 |
0 |
0.000 |
Average: |
436.7 |
-3.0 |
0.310 |
6 |
0 |
0 |
0.000 |
4 |
7 |
|
B |
32 |
11 |
15659 |
◊ |
A |
x,y,z |
1_555 |
21 |
5 |
15669 |
252.2 |
0.8 |
0.671 |
4 |
3 |
0 |
0.001 |
5 |
8 |
|
B |
36 |
13 |
15659 |
◊ |
B |
-x+2,y,-z+5/2 |
3_757 |
36 |
13 |
15659 |
235.1 |
-2.3 |
0.339 |
0 |
0 |
0 |
0.000 |
6 |
9 |
|
A |
22 |
7 |
15669 |
◊ |
B |
-x+2,-y+2,z-1/2 |
2_774 |
21 |
5 |
15659 |
169.8 |
0.4 |
0.639 |
1 |
1 |
0 |
0.000 |
7 |
10 |
|
B |
17 |
8 |
15659 |
◊ |
A |
x-1/2,y+1/2,z |
5_455 |
25 |
6 |
15669 |
166.8 |
-0.8 |
0.455 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
17 |
5 |
15669 |
◊ |
A |
x,-y+1,-z+2 |
4_567 |
17 |
5 |
15669 |
155.8 |
2.8 |
0.903 |
6 |
8 |
0 |
0.000 |
9 |
12 |
|
[FES]B:600 |
4 |
1 |
235 |
f |
B |
x,y,z |
1_555 |
10 |
9 |
15659 |
123.2 |
-16.6 |
0.554 |
1 |
0 |
0 |
0.028 |
13 |
|
[FES]A:500 |
4 |
1 |
234 |
f |
A |
x,y,z |
1_555 |
11 |
10 |
15669 |
122.2 |
-16.4 |
0.564 |
1 |
0 |
0 |
0.028 |
Average: |
122.7 |
-16.5 |
0.559 |
1 |
0 |
0 |
0.028 |
10 |
14 |
|
A |
17 |
7 |
15669 |
◊ |
B |
-x+3/2,-y+3/2,z-1/2 |
6_664 |
11 |
4 |
15659 |
106.2 |
-0.1 |
0.471 |
0 |
4 |
0 |
0.000 |
11 |
15 |
|
B |
15 |
6 |
15659 |
f |
[SO4]A:401 |
x-1/2,-y+3/2,-z+2 |
8_467 |
5 |
1 |
186 |
104.6 |
-13.7 |
0.772 |
3 |
0 |
0 |
0.021 |
12 |
16 |
|
[SO4]A:402 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
15669 |
103.3 |
-13.5 |
0.782 |
3 |
0 |
0 |
0.025 |
13 |
17 |
|
[FAD]B:601 |
9 |
1 |
905 |
◊ |
A |
x-1/2,-y+3/2,-z+2 |
8_467 |
12 |
3 |
15669 |
96.4 |
0.6 |
0.741 |
0 |
0 |
0 |
0.000 |
18 |
|
[FAD]A:501 |
8 |
1 |
899 |
◊ |
B |
x,-y+2,-z+2 |
4_577 |
11 |
3 |
15659 |
91.7 |
0.5 |
0.737 |
1 |
0 |
0 |
0.000 |
Average: |
94.1 |
0.5 |
0.739 |
1 |
0 |
0 |
0.000 |
14 |
19 |
|
[SO4]B:404 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
15659 |
89.5 |
-10.8 |
0.937 |
6 |
0 |
0 |
0.019 |
15 |
20 |
|
[SO4]A:400 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
15669 |
77.0 |
-9.4 |
0.968 |
4 |
0 |
0 |
0.019 |
16 |
21 |
|
[SO4]B:403 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
15669 |
72.9 |
-7.8 |
0.963 |
3 |
0 |
0 |
0.006 |
17 |
22 |
|
[SO4]B:403 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
15659 |
67.9 |
-9.6 |
0.646 |
2 |
0 |
0 |
0.014 |
18 |
23 |
|
B |
9 |
5 |
15659 |
◊ |
B |
x,-y+2,-z+2 |
4_577 |
9 |
5 |
15659 |
56.4 |
0.5 |
0.691 |
0 |
0 |
0 |
0.000 |
19 |
24 |
|
[SO4]A:401 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
15669 |
50.5 |
-5.6 |
0.912 |
1 |
0 |
0 |
0.000 |
20 |
25 |
|
[SO4]A:402 |
4 |
1 |
185 |
◊ |
B |
x,-y+2,-z+2 |
4_577 |
7 |
2 |
15659 |
48.7 |
-5.5 |
0.900 |
2 |
0 |
0 |
0.000 |
21 |
26 |
|
[FAD]B:601 |
4 |
1 |
905 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
15669 |
15.4 |
-1.3 |
0.224 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
A |
4 |
2 |
15669 |
x |
A |
x-1/2,-y+3/2,-z+2 |
8_467 |
4 |
2 |
15669 |
10.9 |
0.2 |
0.657 |
0 |
0 |
0 |
0.000 |
|