| ## |
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 |
|
[FAD]B:523 |
52 |
1 |
1010 |
f |
B |
x,y,z |
1_555 |
112 |
44 |
18652 |
732.5 |
-8.5 |
0.447 |
17 |
0 |
0 |
0.000 |
2 |
|
[FAD]A:523 |
52 |
1 |
1009 |
f |
A |
x,y,z |
1_555 |
112 |
44 |
18836 |
730.7 |
-8.5 |
0.453 |
18 |
0 |
0 |
0.000 |
| Average: |
731.6 |
-8.5 |
0.450 |
18 |
0 |
0 |
0.000 |
| 2 |
3 |
|
B |
46 |
15 |
18652 |
◊ |
A |
x,y,z |
1_555 |
49 |
17 |
18836 |
447.2 |
-6.2 |
0.107 |
3 |
0 |
0 |
0.000 |
| 3 |
4 |
|
A |
47 |
19 |
18836 |
◊ |
B |
-x+1,y-1/2,-z-1 |
2_644 |
49 |
18 |
18652 |
422.1 |
1.7 |
0.850 |
4 |
3 |
0 |
0.000 |
| 4 |
5 |
|
A |
45 |
14 |
18836 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
44 |
14 |
18652 |
383.7 |
-2.6 |
0.418 |
6 |
4 |
0 |
0.000 |
| 5 |
6 |
|
B |
33 |
10 |
18652 |
x |
B |
x-1,y,z |
1_455 |
32 |
9 |
18652 |
243.3 |
1.2 |
0.809 |
2 |
3 |
0 |
0.000 |
7 |
|
A |
32 |
10 |
18836 |
x |
A |
x-1,y,z |
1_455 |
28 |
8 |
18836 |
239.3 |
-0.1 |
0.667 |
2 |
4 |
0 |
0.000 |
| Average: |
241.3 |
0.6 |
0.738 |
2 |
4 |
0 |
0.000 |
| 6 |
8 |
|
[NAG]A:524 |
12 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
25 |
10 |
18836 |
187.1 |
5.6 |
0.608 |
2 |
0 |
0 |
0.000 |
9 |
|
[NAG]B:534 |
12 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
25 |
10 |
18652 |
184.5 |
5.7 |
0.611 |
2 |
0 |
0 |
0.000 |
| Average: |
185.8 |
5.6 |
0.609 |
2 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[NAG]A:525 |
12 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
16 |
6 |
18836 |
166.6 |
4.8 |
0.495 |
3 |
0 |
0 |
0.000 |
11 |
|
[NAG]B:529 |
12 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
15 |
6 |
18652 |
163.9 |
4.9 |
0.519 |
3 |
0 |
0 |
0.000 |
| Average: |
165.2 |
4.8 |
0.507 |
3 |
0 |
0 |
0.000 |
| 8 |
12 |
|
A |
18 |
7 |
18836 |
◊ |
B |
-x+2,y-1/2,-z-1 |
2_744 |
16 |
7 |
18652 |
142.6 |
-1.3 |
0.385 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
[MAN]B:528 |
9 |
1 |
289 |
◊ |
A |
x,y,z |
1_555 |
25 |
8 |
18836 |
137.2 |
0.5 |
0.225 |
1 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[IPA]A:522 |
4 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
31 |
11 |
18836 |
132.7 |
4.5 |
0.552 |
0 |
0 |
0 |
0.000 |
15 |
|
[IPA]B:522 |
4 |
1 |
197 |
f |
B |
x,y,z |
1_555 |
26 |
10 |
18652 |
128.7 |
4.6 |
0.548 |
1 |
0 |
0 |
0.000 |
| Average: |
130.7 |
4.5 |
0.550 |
1 |
0 |
0 |
0.000 |
| 11 |
16 |
|
[NAG]A:533 |
9 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
11 |
5 |
18836 |
108.1 |
3.1 |
0.440 |
1 |
0 |
0 |
0.000 |
| 12 |
17 |
|
[NAG]A:530 |
10 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
15 |
6 |
18836 |
107.3 |
2.8 |
0.391 |
0 |
0 |
0 |
0.000 |
18 |
|
[NAG]B:525 |
10 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
14 |
6 |
18652 |
102.2 |
2.6 |
0.387 |
0 |
0 |
0 |
0.000 |
| Average: |
104.8 |
2.7 |
0.389 |
0 |
0 |
0 |
0.000 |
| 13 |
19 |
|
[NDG]B:533 |
10 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
10 |
5 |
18652 |
106.4 |
2.7 |
0.272 |
2 |
0 |
0 |
0.000 |
| 14 |
20 |
|
[NAG]B:530 |
7 |
1 |
364 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
18652 |
88.9 |
2.6 |
0.510 |
1 |
0 |
0 |
0.000 |
| 15 |
21 |
|
[NAG]A:526 |
6 |
1 |
364 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
18836 |
88.6 |
2.7 |
0.565 |
1 |
0 |
0 |
0.000 |
| 16 |
22 |
|
B |
13 |
4 |
18652 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
8 |
2 |
18652 |
81.4 |
0.1 |
0.665 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
[MAN]B:532 |
7 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
18652 |
77.7 |
1.3 |
0.313 |
1 |
0 |
0 |
0.000 |
| 18 |
24 |
|
[MAN]A:529 |
7 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
18836 |
76.8 |
1.6 |
0.330 |
1 |
0 |
0 |
0.000 |
| 19 |
25 |
|
[FUC]B:526 |
7 |
1 |
281 |
cf |
[NAG]B:525 |
x,y,z |
1_555 |
8 |
1 |
363 |
71.2 |
2.5 |
0.171 |
0 |
0 |
0 |
0.000 |
26 |
|
[FUC]A:532 |
7 |
1 |
281 |
cf |
[NAG]A:530 |
x,y,z |
1_555 |
7 |
1 |
362 |
68.6 |
2.4 |
0.145 |
0 |
0 |
0 |
0.000 |
| Average: |
69.9 |
2.4 |
0.158 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
[NAG]A:526 |
9 |
1 |
364 |
cf |
[NAG]A:525 |
x,y,z |
1_555 |
7 |
1 |
364 |
70.4 |
1.5 |
0.083 |
0 |
0 |
0 |
0.000 |
| 21 |
28 |
|
[NAG]A:531 |
9 |
1 |
361 |
cf |
[NAG]A:530 |
x,y,z |
1_555 |
6 |
1 |
362 |
69.4 |
1.7 |
0.085 |
0 |
0 |
0 |
0.000 |
29 |
|
[NAG]B:525 |
6 |
1 |
363 |
cf |
[NAG]B:524 |
x,y,z |
1_555 |
8 |
1 |
361 |
69.0 |
1.5 |
0.109 |
0 |
0 |
0 |
0.000 |
30 |
|
[NAG]B:530 |
9 |
1 |
364 |
cf |
[NAG]B:529 |
x,y,z |
1_555 |
6 |
1 |
363 |
64.6 |
1.2 |
0.080 |
0 |
0 |
0 |
0.000 |
| Average: |
67.7 |
1.5 |
0.092 |
0 |
0 |
0 |
0.000 |
| 22 |
31 |
|
[FUC]B:526 |
7 |
1 |
281 |
f |
[NAG]B:524 |
x,y,z |
1_555 |
8 |
1 |
361 |
67.0 |
2.9 |
0.165 |
0 |
0 |
0 |
0.000 |
| 23 |
32 |
|
[MAN]A:528 |
7 |
1 |
290 |
cf |
[NAG]A:526 |
x,y,z |
1_555 |
6 |
1 |
364 |
65.0 |
1.8 |
0.115 |
1 |
0 |
0 |
0.000 |
| 24 |
33 |
|
[FUC]A:532 |
7 |
1 |
281 |
f |
[NAG]A:531 |
x,y,z |
1_555 |
8 |
1 |
361 |
64.6 |
2.9 |
0.139 |
0 |
0 |
0 |
0.000 |
| 25 |
34 |
|
A |
8 |
2 |
18836 |
x |
A |
-x+2,y-1/2,-z-1 |
2_744 |
11 |
4 |
18836 |
60.7 |
-0.4 |
0.373 |
0 |
0 |
0 |
0.000 |
| 26 |
35 |
|
[BMA]B:531 |
6 |
1 |
291 |
cf |
[NAG]B:530 |
x,y,z |
1_555 |
6 |
1 |
364 |
60.3 |
0.9 |
0.094 |
0 |
0 |
0 |
0.000 |
36 |
|
[BMA]B:527 |
6 |
1 |
292 |
cf |
[NAG]B:524 |
x,y,z |
1_555 |
5 |
1 |
361 |
59.8 |
0.9 |
0.106 |
0 |
0 |
0 |
0.000 |
| Average: |
60.0 |
0.9 |
0.100 |
0 |
0 |
0 |
0.000 |
| 27 |
37 |
|
[FUL]A:527 |
6 |
1 |
280 |
cf |
[NAG]A:525 |
x,y,z |
1_555 |
7 |
1 |
364 |
58.8 |
1.7 |
0.125 |
0 |
0 |
0 |
0.000 |
| 28 |
38 |
|
[BMA]B:527 |
5 |
1 |
292 |
cf |
[MAN]B:528 |
x,y,z |
1_555 |
6 |
1 |
289 |
57.0 |
2.6 |
0.287 |
0 |
0 |
0 |
0.000 |
| 29 |
39 |
|
[MAN]A:529 |
7 |
1 |
291 |
cf |
[MAN]A:528 |
x,y,z |
1_555 |
5 |
1 |
290 |
56.7 |
2.6 |
0.207 |
0 |
0 |
0 |
0.000 |
| 30 |
40 |
|
[BMA]B:531 |
6 |
1 |
291 |
cf |
[MAN]B:532 |
x,y,z |
1_555 |
6 |
1 |
292 |
55.2 |
2.5 |
0.202 |
0 |
0 |
0 |
0.000 |
| 31 |
41 |
|
[FUL]A:527 |
4 |
1 |
280 |
f |
[NAG]A:526 |
x,y,z |
1_555 |
7 |
1 |
364 |
54.0 |
1.9 |
0.171 |
0 |
0 |
0 |
0.000 |
| 32 |
42 |
|
[NDG]B:533 |
5 |
1 |
362 |
◊ |
A |
x-1,y+1,z |
1_465 |
8 |
3 |
18836 |
52.4 |
0.9 |
0.288 |
0 |
0 |
0 |
0.000 |
| 33 |
43 |
|
[BMA]B:527 |
4 |
1 |
292 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
18836 |
29.6 |
0.2 |
0.263 |
0 |
0 |
0 |
0.000 |
| 34 |
44 |
|
[NAG]A:533 |
3 |
1 |
361 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
18652 |
27.3 |
0.6 |
0.333 |
0 |
0 |
0 |
0.000 |
| 35 |
45 |
|
A |
3 |
1 |
18836 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
3 |
1 |
18652 |
22.1 |
0.3 |
0.773 |
0 |
0 |
0 |
0.000 |
| 36 |
46 |
|
[MAN]B:532 |
3 |
1 |
292 |
f |
[NAG]B:530 |
x,y,z |
1_555 |
3 |
1 |
364 |
21.0 |
0.9 |
0.262 |
0 |
0 |
0 |
0.000 |
| 37 |
47 |
|
[MAN]A:529 |
2 |
1 |
291 |
f |
[NAG]A:526 |
x,y,z |
1_555 |
4 |
1 |
364 |
19.5 |
0.9 |
0.209 |
0 |
0 |
0 |
0.000 |
| 38 |
48 |
|
A |
2 |
1 |
18836 |
◊ |
[NAG]B:530 |
-x+2,y-1/2,-z |
2_745 |
1 |
1 |
364 |
8.2 |
0.2 |
0.590 |
0 |
0 |
0 |
0.000 |
| 39 |
49 |
|
[NAG]A:526 |
2 |
1 |
364 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
2 |
1 |
18652 |
7.5 |
0.2 |
0.393 |
0 |
0 |
0 |
0.000 |
| 40 |
50 |
|
[FUC]A:532 |
1 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
18836 |
5.8 |
0.3 |
0.402 |
0 |
0 |
0 |
0.000 |
51 |
|
[FUC]B:526 |
1 |
1 |
281 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
18652 |
5.5 |
0.2 |
0.400 |
0 |
0 |
0 |
0.000 |
| Average: |
5.6 |
0.3 |
0.401 |
0 |
0 |
0 |
0.000 |
| 41 |
52 |
|
[MAN]B:528 |
3 |
1 |
289 |
f |
[NAG]B:524 |
x,y,z |
1_555 |
2 |
1 |
361 |
4.9 |
0.2 |
0.195 |
0 |
0 |
0 |
0.000 |
| 42 |
53 |
|
[MAN]A:528 |
1 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
18836 |
4.1 |
0.1 |
0.364 |
0 |
0 |
0 |
0.000 |
| 43 |
54 |
|
[FUL]A:527 |
1 |
1 |
280 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
18836 |
2.2 |
0.1 |
0.386 |
0 |
0 |
0 |
0.000 |
| 44 |
55 |
|
[MAN]A:528 |
1 |
1 |
290 |
f |
[FUL]A:527 |
x,y,z |
1_555 |
1 |
1 |
280 |
1.5 |
0.1 |
0.191 |
0 |
0 |
0 |
0.000 |
| 45 |
56 |
|
A |
1 |
1 |
18836 |
◊ |
[BMA]B:531 |
-x+2,y-1/2,-z |
2_745 |
1 |
1 |
291 |
1.4 |
0.0 |
0.285 |
0 |
0 |
0 |
0.000 |
| 46 |
57 |
|
[MAN]A:528 |
1 |
1 |
290 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
1 |
1 |
18652 |
0.6 |
0.0 |
0.311 |
0 |
0 |
0 |
0.000 |
|