## |
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 |
83 |
26 |
17378 |
◊ |
B |
x-1,y-1,z |
1_445 |
80 |
25 |
17376 |
854.0 |
-4.1 |
0.329 |
4 |
0 |
0 |
0.063 |
2 |
|
D |
83 |
26 |
17254 |
◊ |
A |
x,y,z |
1_555 |
80 |
24 |
17444 |
846.1 |
-4.8 |
0.286 |
4 |
0 |
0 |
0.063 |
Average: |
850.0 |
-4.5 |
0.308 |
4 |
0 |
0 |
0.063 |
2 |
3 |
|
[FAD]D:389 |
52 |
1 |
1000 |
f |
D |
x,y,z |
1_555 |
94 |
40 |
17254 |
700.8 |
-4.3 |
0.590 |
12 |
0 |
0 |
0.208 |
4 |
|
[FAD]C:389 |
53 |
1 |
1003 |
f |
C |
x,y,z |
1_555 |
92 |
39 |
17378 |
700.6 |
-5.0 |
0.553 |
12 |
0 |
0 |
0.208 |
5 |
|
[FAD]A:389 |
52 |
1 |
996 |
f |
A |
x,y,z |
1_555 |
97 |
40 |
17444 |
694.1 |
-4.2 |
0.577 |
13 |
0 |
0 |
0.208 |
6 |
|
[FAD]B:389 |
52 |
1 |
991 |
f |
B |
x,y,z |
1_555 |
94 |
39 |
17376 |
681.4 |
-4.5 |
0.561 |
18 |
0 |
0 |
0.208 |
Average: |
694.2 |
-4.5 |
0.570 |
14 |
0 |
0 |
0.208 |
3 |
7 |
|
[T1C]A:392 |
38 |
1 |
810 |
f |
A |
x,y,z |
1_555 |
67 |
26 |
17444 |
444.9 |
-2.5 |
0.524 |
6 |
0 |
0 |
0.093 |
8 |
|
[T1C]B:392 |
39 |
1 |
799 |
f |
B |
x,y,z |
1_555 |
67 |
27 |
17376 |
440.0 |
-2.2 |
0.544 |
4 |
0 |
0 |
0.093 |
9 |
|
[T1C]D:392 |
37 |
1 |
807 |
f |
D |
x,y,z |
1_555 |
60 |
24 |
17254 |
415.7 |
-2.2 |
0.529 |
5 |
0 |
0 |
0.093 |
Average: |
433.5 |
-2.3 |
0.532 |
5 |
0 |
0 |
0.093 |
4 |
10 |
|
B |
57 |
16 |
17376 |
◊ |
A |
x,y,z |
1_555 |
43 |
15 |
17444 |
436.7 |
-4.7 |
0.157 |
1 |
0 |
0 |
0.000 |
5 |
11 |
|
[T1C]C:392 |
36 |
1 |
814 |
f |
C |
x,y,z |
1_555 |
63 |
24 |
17378 |
422.4 |
-2.6 |
0.499 |
5 |
0 |
0 |
0.044 |
6 |
12 |
|
A |
41 |
12 |
17444 |
◊ |
C |
x,y,z-1 |
1_554 |
39 |
11 |
17378 |
361.2 |
-4.1 |
0.191 |
2 |
0 |
0 |
0.000 |
13 |
|
D |
40 |
11 |
17254 |
◊ |
B |
x,y-1,z-1 |
1_544 |
42 |
12 |
17376 |
360.3 |
-3.9 |
0.221 |
2 |
0 |
0 |
0.000 |
Average: |
360.7 |
-4.0 |
0.206 |
2 |
0 |
0 |
0.000 |
7 |
14 |
|
C |
23 |
10 |
17378 |
◊ |
A |
x,y,z |
1_555 |
19 |
8 |
17444 |
187.8 |
-1.8 |
0.313 |
0 |
0 |
0 |
0.000 |
15 |
|
D |
21 |
8 |
17254 |
◊ |
B |
x,y-1,z |
1_545 |
18 |
7 |
17376 |
185.1 |
-1.8 |
0.312 |
0 |
0 |
0 |
0.000 |
Average: |
186.5 |
-1.8 |
0.313 |
0 |
0 |
0 |
0.000 |
8 |
16 |
|
D |
20 |
6 |
17254 |
◊ |
C |
x,y,z |
1_555 |
21 |
6 |
17378 |
153.5 |
0.3 |
0.568 |
1 |
0 |
0 |
0.000 |
17 |
|
C |
20 |
6 |
17378 |
◊ |
D |
x-1,y,z |
1_455 |
21 |
6 |
17254 |
150.6 |
0.3 |
0.577 |
0 |
0 |
0 |
0.000 |
Average: |
152.0 |
0.3 |
0.572 |
1 |
0 |
0 |
0.000 |
9 |
18 |
|
A |
17 |
5 |
17444 |
◊ |
B |
x-1,y,z |
1_455 |
17 |
6 |
17376 |
126.8 |
0.4 |
0.438 |
1 |
2 |
0 |
0.000 |
10 |
19 |
|
D |
13 |
5 |
17254 |
◊ |
B |
x-1,y-1,z |
1_445 |
10 |
2 |
17376 |
98.4 |
1.5 |
0.816 |
0 |
0 |
0 |
0.000 |
20 |
|
C |
12 |
5 |
17378 |
◊ |
A |
x-1,y,z |
1_455 |
10 |
2 |
17444 |
94.7 |
1.5 |
0.818 |
0 |
0 |
0 |
0.000 |
Average: |
96.5 |
1.5 |
0.817 |
0 |
0 |
0 |
0.000 |
11 |
21 |
|
[SO4]A:1384 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
17444 |
92.8 |
-10.0 |
0.921 |
3 |
0 |
0 |
0.108 |
12 |
22 |
|
[SO4]C:1383 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
17378 |
86.8 |
-8.6 |
0.937 |
3 |
0 |
0 |
0.091 |
13 |
23 |
|
[SO4]B:1385 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
17376 |
79.7 |
-7.9 |
0.943 |
1 |
0 |
0 |
0.076 |
14 |
24 |
|
[T1C]A:392 |
10 |
1 |
810 |
f |
[FAD]A:389 |
x,y,z |
1_555 |
9 |
1 |
996 |
78.7 |
-0.3 |
0.617 |
1 |
0 |
0 |
0.013 |
25 |
|
[T1C]C:392 |
11 |
1 |
814 |
f |
[FAD]C:389 |
x,y,z |
1_555 |
8 |
1 |
1003 |
78.3 |
0.1 |
0.660 |
1 |
0 |
0 |
0.013 |
26 |
|
[T1C]D:392 |
11 |
1 |
807 |
f |
[FAD]D:389 |
x,y,z |
1_555 |
8 |
1 |
1000 |
77.4 |
-0.1 |
0.636 |
1 |
0 |
0 |
0.013 |
27 |
|
[T1C]B:392 |
8 |
1 |
799 |
f |
[FAD]B:389 |
x,y,z |
1_555 |
8 |
1 |
991 |
72.8 |
-0.4 |
0.596 |
1 |
0 |
0 |
0.013 |
Average: |
76.8 |
-0.2 |
0.627 |
1 |
0 |
0 |
0.013 |
15 |
28 |
|
[SO4]D:1384 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
12 |
3 |
17254 |
74.1 |
-9.8 |
0.794 |
5 |
0 |
0 |
0.115 |
16 |
29 |
|
[SO4]B:1383 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
17376 |
74.0 |
-10.5 |
0.784 |
2 |
0 |
0 |
0.104 |
17 |
30 |
|
C |
11 |
3 |
17378 |
f |
[SO4]B:1384 |
x-1,y-1,z |
1_445 |
5 |
1 |
187 |
73.5 |
-10.1 |
0.795 |
4 |
0 |
0 |
0.108 |
18 |
31 |
|
[SO4]A:1383 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
17444 |
72.7 |
-10.1 |
0.792 |
3 |
0 |
0 |
0.110 |
19 |
32 |
|
[SO4]C:1384 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
17378 |
69.5 |
-8.2 |
0.946 |
3 |
0 |
0 |
0.087 |
20 |
33 |
|
[SO4]D:1385 |
4 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
17254 |
68.6 |
-8.1 |
0.948 |
4 |
0 |
0 |
0.094 |
21 |
34 |
|
[SO4]D:1383 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
17254 |
68.5 |
-7.5 |
0.899 |
2 |
0 |
0 |
0.080 |
22 |
35 |
|
D |
6 |
3 |
17254 |
◊ |
A |
x,y-1,z |
1_545 |
9 |
4 |
17444 |
66.0 |
-1.0 |
0.213 |
0 |
0 |
0 |
0.000 |
23 |
36 |
|
[SO4]B:1386 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
17376 |
64.8 |
-7.2 |
0.963 |
3 |
0 |
0 |
0.077 |
24 |
37 |
|
[T1C]B:392 |
3 |
1 |
799 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
17444 |
42.4 |
0.0 |
0.510 |
0 |
0 |
0 |
0.000 |
25 |
38 |
|
[SO4]A:1383 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
17254 |
39.2 |
-3.5 |
0.970 |
2 |
0 |
0 |
0.042 |
26 |
39 |
|
[SO4]B:1384 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
17376 |
36.5 |
-3.3 |
0.963 |
2 |
0 |
0 |
0.038 |
27 |
40 |
|
C |
3 |
1 |
17378 |
◊ |
[SO4]B:1383 |
x-1,y-1,z |
1_445 |
4 |
1 |
187 |
36.3 |
-3.3 |
0.966 |
2 |
0 |
0 |
0.038 |
28 |
41 |
|
[SO4]D:1384 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
17444 |
35.3 |
-3.2 |
0.962 |
3 |
0 |
0 |
0.043 |
29 |
42 |
|
C |
5 |
3 |
17378 |
x |
C |
x-1,y,z |
1_455 |
4 |
3 |
17378 |
31.1 |
0.5 |
0.757 |
0 |
0 |
0 |
0.000 |
43 |
|
D |
4 |
2 |
17254 |
x |
D |
x-1,y,z |
1_455 |
3 |
2 |
17254 |
27.6 |
0.4 |
0.753 |
0 |
0 |
0 |
0.000 |
44 |
|
A |
2 |
2 |
17444 |
x |
A |
x-1,y,z |
1_455 |
2 |
2 |
17444 |
11.5 |
-0.0 |
0.493 |
0 |
0 |
0 |
0.000 |
45 |
|
B |
2 |
2 |
17376 |
x |
B |
x-1,y,z |
1_455 |
2 |
2 |
17376 |
11.2 |
-0.0 |
0.499 |
0 |
0 |
0 |
0.000 |
Average: |
20.3 |
0.2 |
0.625 |
0 |
0 |
0 |
0.000 |
30 |
46 |
|
[SO4]D:1383 |
2 |
1 |
187 |
f |
[FAD]D:389 |
x,y,z |
1_555 |
3 |
1 |
1000 |
14.7 |
-1.4 |
0.794 |
0 |
0 |
0 |
0.014 |
31 |
47 |
|
[SO4]D:1384 |
3 |
1 |
185 |
◊ |
[SO4]A:1383 |
x,y,z |
1_555 |
1 |
1 |
186 |
12.4 |
-2.8 |
0.891 |
0 |
0 |
0 |
0.027 |
32 |
48 |
|
[SO4]A:1384 |
1 |
1 |
188 |
f |
[FAD]A:389 |
x,y,z |
1_555 |
3 |
1 |
996 |
11.4 |
-1.2 |
0.693 |
0 |
0 |
0 |
0.012 |
33 |
49 |
|
[SO4]C:1383 |
1 |
1 |
187 |
f |
[FAD]C:389 |
x,y,z |
1_555 |
2 |
1 |
1003 |
11.2 |
-1.2 |
0.685 |
0 |
0 |
0 |
0.011 |
34 |
50 |
|
[SO4]B:1384 |
1 |
1 |
187 |
◊ |
[SO4]B:1383 |
x,y,z |
1_555 |
3 |
1 |
187 |
8.3 |
-1.9 |
0.891 |
0 |
0 |
0 |
0.018 |
|