## |
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 |
|
C |
133 |
44 |
20618 |
◊ |
A |
x,y,z |
1_555 |
145 |
47 |
20700 |
1275.7 |
-1.9 |
0.679 |
15 |
8 |
0 |
0.007 |
2 |
2 |
|
B |
117 |
31 |
6383 |
◊ |
A |
x,y,z |
1_555 |
108 |
30 |
20700 |
1153.4 |
-5.7 |
0.403 |
17 |
15 |
0 |
0.207 |
3 |
3 |
|
D |
107 |
29 |
5821 |
◊ |
C |
x,y,z |
1_555 |
97 |
27 |
20618 |
1048.4 |
-6.7 |
0.350 |
14 |
12 |
0 |
0.168 |
4 |
4 |
|
C |
82 |
23 |
20618 |
◊ |
A |
-x,-x+y,-z+1/3 |
9_555 |
99 |
31 |
20700 |
759.2 |
-5.3 |
0.382 |
7 |
2 |
0 |
0.006 |
5 |
5 |
|
[FAD]A:461 |
52 |
1 |
1009 |
f |
A |
x,y,z |
1_555 |
108 |
41 |
20700 |
738.1 |
-10.0 |
0.301 |
10 |
0 |
0 |
0.192 |
6 |
|
[FAD]C:461 |
51 |
1 |
1003 |
f |
C |
x,y,z |
1_555 |
114 |
40 |
20618 |
725.7 |
-11.0 |
0.265 |
12 |
0 |
0 |
0.192 |
Average: |
731.9 |
-10.5 |
0.283 |
11 |
0 |
0 |
0.192 |
6 |
7 |
|
A |
65 |
15 |
20700 |
◊ |
A |
-x+y,y,-z+1/2 |
11_555 |
64 |
15 |
20700 |
549.2 |
-3.5 |
0.409 |
6 |
0 |
0 |
0.000 |
7 |
8 |
|
C |
54 |
14 |
20618 |
◊ |
A |
x-1,y-1,z |
1_445 |
41 |
10 |
20700 |
413.5 |
-7.1 |
0.100 |
1 |
3 |
0 |
0.000 |
8 |
9 |
|
A |
35 |
10 |
20700 |
x |
A |
-x+1,-x+y,-z+1/3 |
9_655 |
38 |
9 |
20700 |
327.1 |
-0.7 |
0.503 |
1 |
0 |
0 |
0.000 |
9 |
10 |
|
C |
13 |
4 |
20618 |
◊ |
A |
-x+y,y,-z+1/2 |
11_555 |
14 |
8 |
20700 |
132.3 |
-1.2 |
0.373 |
0 |
0 |
0 |
0.000 |
10 |
11 |
|
[FES]D:129 |
4 |
1 |
236 |
f |
D |
x,y,z |
1_555 |
10 |
8 |
5821 |
123.9 |
-16.8 |
0.579 |
1 |
0 |
0 |
0.228 |
12 |
|
[FES]B:129 |
4 |
1 |
237 |
f |
B |
x,y,z |
1_555 |
11 |
8 |
6383 |
123.6 |
-16.7 |
0.588 |
1 |
0 |
0 |
0.228 |
Average: |
123.8 |
-16.7 |
0.583 |
1 |
0 |
0 |
0.228 |
11 |
13 |
|
C |
16 |
7 |
20618 |
◊ |
B |
x-1,y-1,z |
1_445 |
13 |
4 |
6383 |
122.2 |
-2.5 |
0.190 |
0 |
0 |
0 |
0.000 |
12 |
14 |
|
D |
19 |
6 |
5821 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
5 |
20700 |
113.1 |
0.4 |
0.619 |
1 |
0 |
0 |
0.000 |
13 |
15 |
|
[SO4]C:3002 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
20618 |
97.7 |
-15.0 |
0.652 |
3 |
0 |
0 |
0.186 |
14 |
16 |
|
[SO4]A:3001 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
20700 |
95.9 |
-15.1 |
0.656 |
4 |
0 |
0 |
0.224 |
15 |
17 |
|
[SO4]C:3003 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
20618 |
81.6 |
-11.3 |
0.854 |
4 |
0 |
0 |
0.149 |
16 |
18 |
|
D |
11 |
3 |
5821 |
◊ |
B |
x-1,y,z |
1_455 |
9 |
2 |
6383 |
81.4 |
0.2 |
0.507 |
0 |
0 |
0 |
0.000 |
17 |
19 |
|
[SO4]A:3005 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
12 |
8 |
20618 |
77.8 |
-9.5 |
0.885 |
2 |
0 |
0 |
0.119 |
18 |
20 |
|
[SO4]A:3004 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
20700 |
76.1 |
-10.0 |
0.883 |
3 |
0 |
0 |
0.150 |
19 |
21 |
|
C |
10 |
5 |
20618 |
◊ |
C |
-x+y-1,y,-z+1/2 |
11_455 |
10 |
5 |
20618 |
62.7 |
0.6 |
0.738 |
0 |
0 |
0 |
0.000 |
20 |
22 |
|
C |
2 |
1 |
20618 |
◊ |
C |
-x+y,y,-z+1/2 |
11_555 |
2 |
1 |
20618 |
40.6 |
2.1 |
0.971 |
0 |
0 |
0 |
0.000 |
21 |
23 |
|
[SO4]A:3005 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
20700 |
34.6 |
-3.0 |
0.959 |
1 |
0 |
0 |
0.002 |
22 |
24 |
|
D |
5 |
2 |
5821 |
◊ |
C |
-x+y-1,y,-z+1/2 |
11_455 |
7 |
4 |
20618 |
24.8 |
0.2 |
0.669 |
0 |
0 |
0 |
0.000 |
23 |
25 |
|
[FAD]C:461 |
2 |
1 |
1003 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
5821 |
11.7 |
0.3 |
0.671 |
0 |
0 |
0 |
0.000 |
24 |
26 |
|
[SO4]C:3003 |
2 |
1 |
185 |
◊ |
C |
-x+y-1,y,-z+1/2 |
11_455 |
3 |
2 |
20618 |
8.3 |
-1.1 |
0.667 |
0 |
0 |
0 |
0.000 |
25 |
27 |
|
[FAD]A:461 |
2 |
1 |
1009 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
6383 |
3.8 |
0.1 |
0.610 |
0 |
0 |
0 |
0.000 |
|