| ## |
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 |
114 |
29 |
16930 |
◊ |
A |
x,y,z |
1_555 |
116 |
30 |
15633 |
977.9 |
-11.3 |
0.212 |
10 |
4 |
0 |
0.000 |
| 2 |
2 |
|
B |
88 |
22 |
16930 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
105 |
34 |
15633 |
892.0 |
-4.7 |
0.527 |
15 |
1 |
0 |
0.000 |
| 3 |
3 |
|
A |
61 |
17 |
15633 |
◊ |
A |
-x+1,y,-z |
2_655 |
61 |
17 |
15633 |
587.8 |
-8.5 |
0.127 |
4 |
6 |
0 |
0.000 |
| 4 |
4 |
|
B |
51 |
15 |
16930 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
44 |
12 |
15633 |
438.1 |
-4.0 |
0.329 |
4 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[DJN]A:510 |
14 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
38 |
16 |
15633 |
224.4 |
6.1 |
0.536 |
7 |
0 |
0 |
0.000 |
6 |
|
[DJN]B:510 |
14 |
1 |
358 |
f |
B |
x,y,z |
1_555 |
36 |
16 |
16930 |
219.7 |
4.9 |
0.479 |
6 |
0 |
0 |
0.000 |
| Average: |
222.1 |
5.5 |
0.508 |
7 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[CIT]B:511 |
12 |
1 |
314 |
f |
B |
x,y,z |
1_555 |
27 |
7 |
16930 |
182.9 |
1.4 |
0.445 |
5 |
0 |
0 |
0.000 |
8 |
|
[CIT]A:511 |
12 |
1 |
312 |
f |
A |
x,y,z |
1_555 |
21 |
7 |
15633 |
178.5 |
1.4 |
0.419 |
5 |
0 |
0 |
0.000 |
| Average: |
180.7 |
1.4 |
0.432 |
5 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[NAG]A:504 |
12 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
27 |
7 |
15633 |
169.7 |
4.6 |
0.488 |
1 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[NAG]B:504 |
11 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
27 |
8 |
16930 |
169.1 |
5.1 |
0.608 |
0 |
0 |
0 |
0.000 |
| 9 |
11 |
|
B |
14 |
5 |
16930 |
◊ |
B |
-x,y,-z+1 |
2_556 |
14 |
5 |
16930 |
139.0 |
0.9 |
0.781 |
2 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[GOL]A:517 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
15633 |
134.8 |
-0.8 |
0.499 |
5 |
0 |
0 |
0.000 |
| 11 |
13 |
|
[GOL]B:512 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
24 |
10 |
16930 |
134.2 |
-0.8 |
0.571 |
4 |
0 |
0 |
0.000 |
| 12 |
14 |
|
[GOL]A:518 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
15633 |
128.5 |
-0.4 |
0.532 |
6 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[GOL]A:514 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
22 |
7 |
15633 |
124.6 |
-0.5 |
0.587 |
3 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[GOL]B:515 |
5 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
20 |
6 |
16930 |
121.6 |
-0.6 |
0.497 |
4 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[GOL]B:518 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
16930 |
119.6 |
-0.5 |
0.505 |
2 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[NAG]B:501 |
10 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
15 |
5 |
16930 |
119.1 |
3.7 |
0.498 |
0 |
0 |
0 |
0.000 |
| 17 |
19 |
|
[NAG]A:501 |
7 |
1 |
366 |
cf |
A |
x,y,z |
1_555 |
17 |
5 |
15633 |
111.8 |
3.5 |
0.627 |
0 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[GOL]A:512 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
15633 |
100.6 |
0.3 |
0.629 |
3 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[GOL]A:516 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
15633 |
98.5 |
0.1 |
0.629 |
4 |
0 |
0 |
0.000 |
| 20 |
22 |
|
[GOL]B:516 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
16930 |
98.3 |
0.2 |
0.639 |
5 |
0 |
0 |
0.000 |
| 21 |
23 |
|
[GOL]B:517 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
16930 |
95.5 |
-1.3 |
0.270 |
1 |
0 |
0 |
0.000 |
| 22 |
24 |
|
[NAG]B:504 |
9 |
1 |
364 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
12 |
4 |
15633 |
86.2 |
1.6 |
0.279 |
0 |
0 |
0 |
0.000 |
| 23 |
25 |
|
[NAG]B:509 |
7 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
9 |
3 |
16930 |
84.8 |
2.8 |
0.510 |
0 |
0 |
0 |
0.000 |
26 |
|
[NAG]A:509 |
7 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
10 |
3 |
15633 |
82.8 |
2.8 |
0.496 |
0 |
0 |
0 |
0.000 |
| Average: |
83.8 |
2.8 |
0.503 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
[GOL]B:513 |
5 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
16930 |
84.8 |
-0.5 |
0.436 |
1 |
0 |
0 |
0.000 |
| 25 |
28 |
|
[NAG]B:505 |
8 |
1 |
358 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
16930 |
78.9 |
2.5 |
0.417 |
1 |
0 |
0 |
0.000 |
| 26 |
29 |
|
[GOL]A:513 |
5 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
15633 |
77.8 |
-1.2 |
0.398 |
0 |
0 |
0 |
0.000 |
| 27 |
30 |
|
B |
14 |
3 |
16930 |
◊ |
[BMA]A:506 |
-x+1/2,y-1/2,-z |
4_545 |
8 |
1 |
294 |
77.1 |
1.9 |
0.363 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
[NAG]A:505 |
8 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
15633 |
74.7 |
2.2 |
0.412 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[GOL]B:514 |
5 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
16930 |
74.3 |
-1.1 |
0.481 |
0 |
0 |
0 |
0.000 |
| 30 |
33 |
|
[NAG]B:505 |
10 |
1 |
358 |
cf |
[NAG]B:504 |
x,y,z |
1_555 |
7 |
1 |
364 |
72.0 |
1.7 |
0.076 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
[NAG]A:505 |
9 |
1 |
361 |
cf |
[NAG]A:504 |
x,y,z |
1_555 |
6 |
1 |
362 |
71.9 |
1.7 |
0.095 |
0 |
0 |
0 |
0.000 |
| 32 |
35 |
|
[NAG]A:502 |
9 |
1 |
365 |
cf |
[NAG]A:501 |
x,y,z |
1_555 |
6 |
1 |
366 |
71.6 |
1.7 |
0.091 |
0 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[NAG]B:502 |
10 |
1 |
365 |
cf |
[NAG]B:501 |
x,y,z |
1_555 |
6 |
1 |
364 |
69.7 |
1.6 |
0.089 |
0 |
0 |
0 |
0.000 |
| 34 |
37 |
|
[BMA]A:503 |
6 |
1 |
289 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
13 |
6 |
15633 |
69.0 |
0.1 |
0.254 |
1 |
0 |
0 |
0.000 |
| 35 |
38 |
|
[BMA]A:506 |
6 |
1 |
294 |
cf |
[NAG]A:505 |
x,y,z |
1_555 |
6 |
1 |
361 |
59.5 |
1.0 |
0.106 |
0 |
0 |
0 |
0.000 |
39 |
|
[BMA]B:506 |
7 |
1 |
291 |
cf |
[NAG]B:505 |
x,y,z |
1_555 |
5 |
1 |
358 |
59.0 |
1.1 |
0.103 |
0 |
0 |
0 |
0.000 |
| Average: |
59.3 |
1.0 |
0.105 |
0 |
0 |
0 |
0.000 |
| 36 |
40 |
|
[BMA]A:503 |
6 |
1 |
289 |
cf |
[NAG]A:502 |
x,y,z |
1_555 |
4 |
1 |
365 |
58.2 |
1.3 |
0.129 |
0 |
0 |
0 |
0.000 |
| 37 |
41 |
|
B |
8 |
5 |
16930 |
◊ |
[MAN]A:507 |
-x+1/2,y-1/2,-z |
4_545 |
5 |
1 |
291 |
57.7 |
1.2 |
0.400 |
0 |
0 |
0 |
0.000 |
| 38 |
42 |
|
[FUC]B:503 |
5 |
1 |
279 |
cf |
[NAG]B:501 |
x,y,z |
1_555 |
5 |
1 |
364 |
55.4 |
2.2 |
0.269 |
0 |
0 |
0 |
0.000 |
| 39 |
43 |
|
[MAN]A:507 |
7 |
1 |
291 |
cf |
[BMA]A:506 |
x,y,z |
1_555 |
5 |
1 |
294 |
54.8 |
2.5 |
0.203 |
0 |
0 |
0 |
0.000 |
| 40 |
44 |
|
[MAN]B:507 |
6 |
1 |
292 |
cf |
[BMA]B:506 |
x,y,z |
1_555 |
5 |
1 |
291 |
54.3 |
2.6 |
0.265 |
0 |
0 |
0 |
0.000 |
| 41 |
45 |
|
[MAN]A:508 |
5 |
1 |
293 |
cf |
[BMA]A:506 |
x,y,z |
1_555 |
3 |
1 |
294 |
52.7 |
2.3 |
0.327 |
0 |
0 |
0 |
0.000 |
| 42 |
46 |
|
[MAN]B:508 |
5 |
1 |
294 |
cf |
[BMA]B:506 |
x,y,z |
1_555 |
3 |
1 |
291 |
51.3 |
2.2 |
0.331 |
0 |
0 |
0 |
0.000 |
| 43 |
47 |
|
[GOL]B:516 |
2 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
15633 |
46.9 |
0.3 |
0.697 |
1 |
0 |
0 |
0.000 |
| 44 |
48 |
|
[FUC]B:503 |
4 |
1 |
279 |
f |
[NAG]B:502 |
x,y,z |
1_555 |
7 |
1 |
365 |
42.6 |
2.0 |
0.212 |
0 |
0 |
0 |
0.000 |
| 45 |
49 |
|
[GOL]A:516 |
2 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
16930 |
42.3 |
0.4 |
0.683 |
1 |
0 |
0 |
0.000 |
| 46 |
50 |
|
[GOL]B:517 |
3 |
1 |
220 |
f |
[DJN]B:510 |
x,y,z |
1_555 |
5 |
1 |
358 |
41.5 |
1.3 |
0.330 |
2 |
0 |
0 |
0.000 |
| 47 |
51 |
|
B |
6 |
1 |
16930 |
◊ |
[NAG]A:505 |
-x+1/2,y-1/2,-z |
4_545 |
7 |
1 |
361 |
41.1 |
0.6 |
0.241 |
0 |
0 |
0 |
0.000 |
| 48 |
52 |
|
[MAN]A:508 |
6 |
1 |
293 |
f |
[NAG]A:505 |
x,y,z |
1_555 |
5 |
1 |
361 |
37.8 |
1.4 |
0.168 |
0 |
0 |
0 |
0.000 |
| 49 |
53 |
|
[GOL]A:514 |
3 |
1 |
216 |
f |
[DJN]A:510 |
x,y,z |
1_555 |
3 |
1 |
361 |
35.9 |
1.0 |
0.525 |
1 |
0 |
0 |
0.000 |
| 50 |
54 |
|
B |
6 |
3 |
16930 |
◊ |
[MAN]A:508 |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
293 |
29.8 |
1.3 |
0.503 |
0 |
0 |
0 |
0.000 |
| 51 |
55 |
|
[GOL]B:515 |
2 |
1 |
221 |
f |
[DJN]B:510 |
x,y,z |
1_555 |
4 |
1 |
358 |
29.7 |
0.2 |
0.211 |
0 |
0 |
0 |
0.000 |
| 52 |
56 |
|
[FUC]B:503 |
4 |
1 |
279 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
16930 |
27.0 |
0.6 |
0.372 |
0 |
0 |
0 |
0.000 |
| 53 |
57 |
|
[MAN]B:508 |
5 |
1 |
294 |
f |
[NAG]B:505 |
x,y,z |
1_555 |
3 |
1 |
358 |
23.7 |
1.0 |
0.185 |
0 |
0 |
0 |
0.000 |
| 54 |
58 |
|
[BMA]A:503 |
6 |
1 |
289 |
◊ |
[NAG]A:501 |
-x+1,y,-z+1 |
2_656 |
3 |
1 |
366 |
22.9 |
1.2 |
0.176 |
0 |
0 |
0 |
0.000 |
| 55 |
59 |
|
[MAN]A:507 |
6 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
15633 |
20.1 |
0.2 |
0.191 |
0 |
0 |
0 |
0.000 |
| 56 |
60 |
|
[GOL]B:514 |
3 |
1 |
218 |
f |
[GOL]B:513 |
x,y,z |
1_555 |
4 |
1 |
219 |
18.8 |
0.1 |
0.642 |
0 |
0 |
0 |
0.000 |
| 57 |
61 |
|
[MAN]B:507 |
3 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
4 |
1 |
16930 |
17.3 |
0.1 |
0.315 |
0 |
0 |
0 |
0.000 |
| 58 |
62 |
|
[BMA]A:506 |
3 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
15633 |
12.6 |
0.5 |
0.431 |
0 |
0 |
0 |
0.000 |
| 59 |
63 |
|
[BMA]B:506 |
3 |
1 |
291 |
f |
B |
x,y,z |
1_555 |
2 |
2 |
16930 |
9.9 |
0.3 |
0.391 |
0 |
0 |
0 |
0.000 |
| 60 |
64 |
|
[NAG]B:505 |
3 |
1 |
358 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
15633 |
9.8 |
0.3 |
0.436 |
0 |
0 |
0 |
0.000 |
| 61 |
65 |
|
[MAN]B:507 |
1 |
1 |
292 |
f |
[NAG]B:505 |
x,y,z |
1_555 |
2 |
1 |
358 |
9.2 |
0.2 |
0.193 |
0 |
0 |
0 |
0.000 |
| 62 |
66 |
|
[GOL]B:517 |
2 |
1 |
220 |
◊ |
[GOL]A:516 |
x,y,z |
1_555 |
1 |
1 |
217 |
6.6 |
0.1 |
0.540 |
0 |
0 |
0 |
0.000 |
| 63 |
67 |
|
[MAN]A:507 |
1 |
1 |
291 |
f |
[NAG]A:505 |
x,y,z |
1_555 |
1 |
1 |
361 |
6.6 |
0.1 |
0.161 |
0 |
0 |
0 |
0.000 |
|