| ## |
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 |
259 |
57 |
18959 |
◊ |
A |
x,y,z |
1_555 |
263 |
58 |
19105 |
2634.0 |
-26.4 |
0.155 |
36 |
15 |
0 |
0.605 |
2 |
|
D |
261 |
56 |
19189 |
◊ |
B |
x,y,z |
1_555 |
264 |
56 |
19245 |
2617.7 |
-27.6 |
0.145 |
32 |
16 |
0 |
0.605 |
| Average: |
2625.8 |
-27.0 |
0.150 |
34 |
16 |
0 |
0.605 |
| 2 |
3 |
|
B |
202 |
59 |
19245 |
◊ |
A |
x,y,z |
1_555 |
210 |
60 |
19105 |
1922.6 |
-29.2 |
0.018 |
16 |
2 |
0 |
0.525 |
4 |
|
D |
205 |
61 |
19189 |
◊ |
C |
x,y,z |
1_555 |
209 |
61 |
18959 |
1922.5 |
-29.0 |
0.016 |
16 |
2 |
0 |
0.525 |
| Average: |
1922.6 |
-29.1 |
0.017 |
16 |
2 |
0 |
0.525 |
| 3 |
5 |
|
A |
80 |
22 |
19105 |
◊ |
D |
y,x-1,-z |
4_545 |
69 |
19 |
19189 |
661.1 |
-1.8 |
0.728 |
11 |
2 |
0 |
0.000 |
| 4 |
6 |
|
C |
69 |
22 |
18959 |
◊ |
C |
-x,-x+y,-z-1/3 |
6_554 |
67 |
22 |
18959 |
653.0 |
-1.1 |
0.742 |
5 |
4 |
0 |
0.000 |
| 5 |
7 |
|
[FAD]C:500 |
47 |
1 |
981 |
f |
C |
x,y,z |
1_555 |
74 |
29 |
18959 |
532.7 |
-6.9 |
0.399 |
15 |
0 |
0 |
0.383 |
8 |
|
[FAD]B:500 |
46 |
1 |
980 |
f |
B |
x,y,z |
1_555 |
73 |
27 |
19245 |
532.7 |
-6.9 |
0.416 |
17 |
0 |
0 |
0.383 |
9 |
|
[FAD]D:500 |
46 |
1 |
980 |
f |
D |
x,y,z |
1_555 |
74 |
28 |
19189 |
530.5 |
-6.7 |
0.398 |
13 |
0 |
0 |
0.383 |
10 |
|
[FAD]A:500 |
46 |
1 |
977 |
f |
A |
x,y,z |
1_555 |
72 |
28 |
19105 |
529.3 |
-6.7 |
0.395 |
13 |
0 |
0 |
0.383 |
| Average: |
531.3 |
-6.8 |
0.402 |
15 |
0 |
0 |
0.383 |
| 6 |
11 |
|
[FAD]C:500 |
31 |
1 |
981 |
◊ |
D |
x,y,z |
1_555 |
34 |
13 |
19189 |
271.5 |
-4.9 |
0.227 |
2 |
0 |
0 |
0.164 |
12 |
|
[FAD]A:500 |
32 |
1 |
977 |
◊ |
B |
x,y,z |
1_555 |
33 |
14 |
19245 |
270.9 |
-5.1 |
0.211 |
2 |
0 |
0 |
0.164 |
13 |
|
[FAD]B:500 |
32 |
1 |
980 |
◊ |
A |
x,y,z |
1_555 |
31 |
13 |
19105 |
270.6 |
-4.6 |
0.245 |
2 |
0 |
0 |
0.164 |
14 |
|
[FAD]D:500 |
33 |
1 |
980 |
◊ |
C |
x,y,z |
1_555 |
33 |
13 |
18959 |
267.4 |
-4.6 |
0.253 |
2 |
0 |
0 |
0.164 |
| Average: |
270.1 |
-4.8 |
0.234 |
2 |
0 |
0 |
0.164 |
| 7 |
15 |
|
D |
23 |
9 |
19189 |
◊ |
D |
y+1,x-1,-z |
4_645 |
22 |
9 |
19189 |
187.0 |
0.2 |
0.740 |
4 |
0 |
0 |
0.000 |
| 8 |
16 |
|
[N6C]A:600 |
9 |
1 |
309 |
◊ |
A |
x,y,z |
1_555 |
33 |
15 |
19105 |
175.7 |
4.8 |
0.364 |
2 |
0 |
0 |
0.000 |
17 |
|
[N6C]C:600 |
9 |
1 |
308 |
◊ |
C |
x,y,z |
1_555 |
33 |
15 |
18959 |
175.5 |
5.1 |
0.435 |
2 |
0 |
0 |
0.000 |
18 |
|
[N6C]B:600 |
9 |
1 |
307 |
◊ |
B |
x,y,z |
1_555 |
32 |
14 |
19245 |
175.3 |
5.0 |
0.407 |
2 |
0 |
0 |
0.000 |
19 |
|
[N6C]D:600 |
9 |
1 |
306 |
◊ |
D |
x,y,z |
1_555 |
34 |
16 |
19189 |
172.8 |
4.8 |
0.351 |
2 |
0 |
0 |
0.000 |
| Average: |
174.8 |
4.9 |
0.389 |
2 |
0 |
0 |
0.000 |
| 9 |
20 |
|
C |
18 |
8 |
18959 |
◊ |
B |
-x+1,-x+y,-z-1/3 |
6_654 |
18 |
7 |
19245 |
161.8 |
0.8 |
0.667 |
1 |
0 |
0 |
0.000 |
| 10 |
21 |
|
D |
19 |
4 |
19189 |
◊ |
A |
x,y,z |
1_555 |
19 |
4 |
19105 |
153.7 |
3.3 |
0.957 |
6 |
0 |
0 |
0.000 |
22 |
|
C |
17 |
4 |
18959 |
◊ |
B |
x,y,z |
1_555 |
18 |
4 |
19245 |
152.2 |
3.2 |
0.955 |
6 |
0 |
0 |
0.000 |
| Average: |
153.0 |
3.2 |
0.956 |
6 |
0 |
0 |
0.000 |
| 11 |
23 |
|
[GOL]D:700 |
6 |
1 |
222 |
f |
D |
x,y,z |
1_555 |
27 |
11 |
19189 |
151.6 |
-0.8 |
0.581 |
2 |
0 |
0 |
0.023 |
24 |
|
[GOL]B:700 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
27 |
11 |
19245 |
150.4 |
0.8 |
0.709 |
2 |
0 |
0 |
0.023 |
25 |
|
[GOL]C:700 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
26 |
11 |
18959 |
148.1 |
1.0 |
0.712 |
2 |
0 |
0 |
0.023 |
| Average: |
150.0 |
0.4 |
0.668 |
2 |
0 |
0 |
0.023 |
| 12 |
26 |
|
[GOL]A:700 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
27 |
10 |
19105 |
149.9 |
-0.7 |
0.592 |
1 |
0 |
0 |
0.016 |
| 13 |
27 |
|
[GOL]B:701 |
6 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
13 |
8 |
19245 |
98.0 |
0.4 |
0.709 |
5 |
0 |
0 |
0.051 |
28 |
|
[GOL]D:701 |
6 |
1 |
219 |
f |
D |
x,y,z |
1_555 |
13 |
8 |
19189 |
97.3 |
0.2 |
0.643 |
5 |
0 |
0 |
0.051 |
| Average: |
97.7 |
0.3 |
0.676 |
5 |
0 |
0 |
0.051 |
| 14 |
29 |
|
[GOL]C:701 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
13 |
8 |
18959 |
97.3 |
0.4 |
0.684 |
4 |
0 |
0 |
0.020 |
| 15 |
30 |
|
[GOL]A:701 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
19105 |
96.0 |
0.3 |
0.659 |
4 |
0 |
0 |
0.020 |
| 16 |
31 |
|
D |
13 |
5 |
19189 |
◊ |
B |
-x+1,-x+y,-z-1/3 |
6_654 |
9 |
5 |
19245 |
86.5 |
-1.2 |
0.420 |
0 |
0 |
0 |
0.000 |
| 17 |
32 |
|
[N6C]D:600 |
7 |
1 |
306 |
◊ |
[FAD]D:500 |
x,y,z |
1_555 |
15 |
1 |
980 |
65.0 |
1.4 |
0.012 |
2 |
0 |
0 |
0.000 |
33 |
|
[N6C]A:600 |
7 |
1 |
309 |
◊ |
[FAD]A:500 |
x,y,z |
1_555 |
16 |
1 |
977 |
64.9 |
1.4 |
0.012 |
2 |
0 |
0 |
0.000 |
34 |
|
[N6C]C:600 |
7 |
1 |
308 |
◊ |
[FAD]C:500 |
x,y,z |
1_555 |
14 |
1 |
981 |
64.3 |
1.3 |
0.013 |
1 |
0 |
0 |
0.000 |
35 |
|
[N6C]B:600 |
6 |
1 |
307 |
◊ |
[FAD]B:500 |
x,y,z |
1_555 |
14 |
1 |
980 |
64.2 |
1.3 |
0.030 |
2 |
0 |
0 |
0.000 |
| Average: |
64.6 |
1.3 |
0.017 |
2 |
0 |
0 |
0.000 |
| 18 |
36 |
|
[GOL]A:701 |
3 |
1 |
217 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
18959 |
51.1 |
-0.4 |
0.448 |
1 |
0 |
0 |
0.012 |
| 19 |
37 |
|
[GOL]D:701 |
4 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
19245 |
50.5 |
-0.1 |
0.601 |
1 |
0 |
0 |
0.012 |
38 |
|
[GOL]B:701 |
4 |
1 |
222 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
19189 |
47.3 |
0.1 |
0.605 |
1 |
0 |
0 |
0.012 |
| Average: |
48.9 |
-0.0 |
0.603 |
1 |
0 |
0 |
0.012 |
| 20 |
39 |
|
[GOL]C:701 |
4 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
19105 |
49.6 |
-0.1 |
0.611 |
1 |
0 |
0 |
0.007 |
| 21 |
40 |
|
[FAD]D:500 |
3 |
1 |
980 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
19245 |
34.6 |
1.0 |
0.839 |
0 |
0 |
0 |
0.000 |
41 |
|
[FAD]A:500 |
3 |
1 |
977 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
18959 |
34.6 |
1.0 |
0.842 |
0 |
0 |
0 |
0.000 |
42 |
|
[FAD]B:500 |
3 |
1 |
980 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
19189 |
34.5 |
1.0 |
0.833 |
0 |
0 |
0 |
0.000 |
43 |
|
[FAD]C:500 |
3 |
1 |
981 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
19105 |
33.6 |
1.0 |
0.828 |
0 |
0 |
0 |
0.000 |
| Average: |
34.3 |
1.0 |
0.836 |
0 |
0 |
0 |
0.000 |
| 22 |
44 |
|
B |
2 |
1 |
19245 |
x |
B |
-x+1,-x+y,-z-1/3 |
6_654 |
4 |
1 |
19245 |
16.4 |
-0.0 |
0.646 |
0 |
0 |
0 |
0.000 |
| 23 |
45 |
|
[GOL]D:700 |
2 |
1 |
222 |
f |
[FAD]D:500 |
x,y,z |
1_555 |
3 |
1 |
980 |
5.6 |
0.1 |
0.570 |
0 |
0 |
0 |
0.000 |
| 24 |
46 |
|
[GOL]B:700 |
1 |
1 |
221 |
f |
[FAD]B:500 |
x,y,z |
1_555 |
3 |
1 |
980 |
5.6 |
0.1 |
0.524 |
0 |
0 |
0 |
0.000 |
47 |
|
[GOL]C:700 |
1 |
1 |
219 |
f |
[FAD]C:500 |
x,y,z |
1_555 |
3 |
1 |
981 |
4.6 |
0.0 |
0.517 |
0 |
0 |
0 |
0.000 |
| Average: |
5.1 |
0.0 |
0.521 |
0 |
0 |
0 |
0.000 |
| 25 |
48 |
|
[GOL]A:700 |
1 |
1 |
220 |
f |
[FAD]A:500 |
x,y,z |
1_555 |
2 |
1 |
977 |
4.3 |
0.1 |
0.522 |
0 |
0 |
0 |
0.000 |
| 26 |
49 |
|
[N6C]B:600 |
1 |
1 |
307 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
19105 |
1.0 |
-0.0 |
0.213 |
0 |
0 |
0 |
0.000 |
50 |
|
[N6C]A:600 |
1 |
1 |
309 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
19245 |
0.2 |
-0.0 |
0.255 |
0 |
0 |
0 |
0.000 |
| Average: |
0.6 |
-0.0 |
0.234 |
0 |
0 |
0 |
0.000 |
| 27 |
51 |
|
[N6C]C:600 |
1 |
1 |
308 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
19189 |
0.8 |
-0.0 |
0.219 |
0 |
0 |
0 |
0.000 |
|