| ## |
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 |
118 |
31 |
11963 |
◊ |
A |
x,y,z |
1_555 |
119 |
31 |
12221 |
1109.2 |
-11.6 |
0.131 |
10 |
7 |
0 |
0.000 |
| 2 |
2 |
|
B |
78 |
21 |
11963 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
81 |
21 |
12221 |
737.6 |
-1.2 |
0.589 |
7 |
8 |
0 |
0.000 |
| 3 |
3 |
|
B |
43 |
12 |
11963 |
◊ |
A |
x-1,y,z |
1_455 |
44 |
15 |
12221 |
353.8 |
3.0 |
0.826 |
8 |
2 |
0 |
0.000 |
| 4 |
4 |
|
A |
32 |
7 |
12221 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
43 |
10 |
12221 |
315.2 |
0.1 |
0.568 |
1 |
1 |
0 |
0.000 |
| 5 |
5 |
|
B |
23 |
7 |
11963 |
x |
B |
x-1/2,-y-1/2,-z+1 |
4_446 |
17 |
7 |
11963 |
185.7 |
2.1 |
0.818 |
3 |
4 |
0 |
0.000 |
| 6 |
6 |
|
[NAG]B:1 |
12 |
1 |
359 |
cf |
B |
x,y,z |
1_555 |
22 |
7 |
11963 |
152.2 |
3.3 |
0.306 |
1 |
0 |
0 |
0.000 |
| 7 |
7 |
|
[NAG]A:1 |
12 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
20 |
6 |
12221 |
149.7 |
3.7 |
0.366 |
1 |
0 |
0 |
0.000 |
| 8 |
8 |
|
[NAG]B:8 |
10 |
1 |
357 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
11963 |
134.8 |
2.8 |
0.330 |
2 |
0 |
0 |
0.000 |
| 9 |
9 |
|
[NAG]A:8 |
10 |
1 |
362 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
12221 |
127.4 |
2.6 |
0.328 |
2 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[NAG]B:2 |
11 |
1 |
364 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
11963 |
111.8 |
1.6 |
0.187 |
1 |
0 |
0 |
0.000 |
11 |
|
[NAG]A:2 |
11 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
12221 |
111.2 |
1.7 |
0.223 |
1 |
0 |
0 |
0.000 |
| Average: |
111.5 |
1.7 |
0.205 |
1 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[FUC]A:11 |
5 |
1 |
280 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
12221 |
77.1 |
2.3 |
0.592 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[MAN]A:7 |
8 |
1 |
292 |
cf |
[NAG]A:8 |
x,y,z |
1_555 |
8 |
1 |
362 |
75.1 |
2.9 |
0.130 |
0 |
0 |
0 |
0.000 |
14 |
|
[MAN]A:4 |
7 |
1 |
289 |
cf |
[NAG]A:5 |
x,y,z |
1_555 |
7 |
1 |
357 |
65.7 |
2.3 |
0.130 |
0 |
0 |
0 |
0.000 |
| Average: |
70.4 |
2.6 |
0.130 |
0 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[NAG]A:2 |
9 |
1 |
363 |
cf |
[NAG]A:1 |
x,y,z |
1_555 |
6 |
1 |
361 |
74.7 |
1.9 |
0.098 |
1 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[NAG]B:2 |
9 |
1 |
364 |
cf |
[NAG]B:1 |
x,y,z |
1_555 |
6 |
1 |
359 |
74.4 |
2.0 |
0.098 |
1 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[MAN]B:4 |
7 |
1 |
295 |
cf |
[NAG]B:5 |
x,y,z |
1_555 |
9 |
1 |
359 |
73.2 |
3.1 |
0.145 |
0 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[MAN]B:7 |
8 |
1 |
292 |
cf |
[NAG]B:8 |
x,y,z |
1_555 |
7 |
1 |
357 |
72.3 |
2.7 |
0.157 |
0 |
0 |
0 |
0.000 |
| 17 |
19 |
|
[FUC]B:11 |
4 |
1 |
280 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
11963 |
69.1 |
1.4 |
0.473 |
0 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[BMA]A:3 |
7 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
9 |
2 |
12221 |
68.1 |
0.7 |
0.177 |
0 |
0 |
0 |
0.000 |
21 |
|
[BMA]B:3 |
7 |
1 |
294 |
f |
B |
x,y,z |
1_555 |
8 |
2 |
11963 |
66.9 |
0.8 |
0.170 |
0 |
0 |
0 |
0.000 |
| Average: |
67.5 |
0.7 |
0.173 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
[FUC]A:11 |
6 |
1 |
280 |
cf |
[NAG]A:1 |
x,y,z |
1_555 |
6 |
1 |
361 |
63.6 |
2.4 |
0.182 |
0 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[FUC]B:11 |
6 |
1 |
280 |
cf |
[NAG]B:1 |
x,y,z |
1_555 |
7 |
1 |
359 |
59.2 |
2.3 |
0.168 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[MAN]B:4 |
7 |
1 |
295 |
cf |
[BMA]B:3 |
x,y,z |
1_555 |
6 |
1 |
294 |
58.0 |
2.6 |
0.211 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
[BMA]A:3 |
6 |
1 |
292 |
cf |
[NAG]A:2 |
x,y,z |
1_555 |
5 |
1 |
363 |
57.3 |
1.1 |
0.131 |
1 |
0 |
0 |
0.000 |
26 |
|
[BMA]B:3 |
7 |
1 |
294 |
cf |
[NAG]B:2 |
x,y,z |
1_555 |
5 |
1 |
364 |
55.9 |
1.0 |
0.099 |
1 |
0 |
0 |
0.000 |
| Average: |
56.6 |
1.1 |
0.115 |
1 |
0 |
0 |
0.000 |
| 23 |
27 |
|
[MAN]B:7 |
5 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
11963 |
57.1 |
1.7 |
0.472 |
1 |
0 |
0 |
0.000 |
28 |
|
[MAN]A:7 |
5 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
12221 |
55.9 |
1.6 |
0.442 |
1 |
0 |
0 |
0.000 |
| Average: |
56.5 |
1.7 |
0.457 |
1 |
0 |
0 |
0.000 |
| 24 |
29 |
|
[MAN]A:4 |
6 |
1 |
289 |
cf |
[BMA]A:3 |
x,y,z |
1_555 |
5 |
1 |
292 |
56.5 |
2.5 |
0.283 |
0 |
0 |
0 |
0.000 |
| 25 |
30 |
|
[MAN]B:7 |
7 |
1 |
292 |
f |
[NAG]B:2 |
x,y,z |
1_555 |
6 |
1 |
364 |
54.6 |
1.8 |
0.134 |
0 |
0 |
0 |
0.000 |
31 |
|
[MAN]A:7 |
6 |
1 |
292 |
f |
[NAG]A:2 |
x,y,z |
1_555 |
6 |
1 |
363 |
53.5 |
1.9 |
0.155 |
0 |
0 |
0 |
0.000 |
| Average: |
54.1 |
1.8 |
0.145 |
0 |
0 |
0 |
0.000 |
| 26 |
32 |
|
B |
4 |
1 |
11963 |
◊ |
[NAG]A:8 |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
1 |
362 |
50.2 |
1.5 |
0.268 |
0 |
0 |
0 |
0.000 |
33 |
|
[NAG]B:8 |
7 |
1 |
357 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
12221 |
47.7 |
1.6 |
0.347 |
0 |
0 |
0 |
0.000 |
| Average: |
49.0 |
1.6 |
0.308 |
0 |
0 |
0 |
0.000 |
| 27 |
34 |
|
[MAN]B:4 |
6 |
1 |
295 |
◊ |
[MAN]A:4 |
x,y,z |
1_555 |
6 |
1 |
289 |
49.6 |
0.3 |
0.072 |
0 |
0 |
0 |
0.000 |
| 28 |
35 |
|
[MAN]B:7 |
6 |
1 |
292 |
cf |
[BMA]B:3 |
x,y,z |
1_555 |
3 |
1 |
294 |
48.8 |
2.1 |
0.281 |
0 |
0 |
0 |
0.000 |
| 29 |
36 |
|
[MAN]A:7 |
6 |
1 |
292 |
cf |
[BMA]A:3 |
x,y,z |
1_555 |
3 |
1 |
292 |
48.3 |
2.2 |
0.275 |
0 |
0 |
0 |
0.000 |
| 30 |
37 |
|
[FUC]B:11 |
4 |
1 |
280 |
f |
[NAG]B:2 |
x,y,z |
1_555 |
5 |
1 |
364 |
45.5 |
2.2 |
0.276 |
1 |
0 |
0 |
0.000 |
| 31 |
38 |
|
[NAG]A:5 |
5 |
1 |
357 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
12221 |
40.9 |
1.7 |
0.434 |
0 |
0 |
0 |
0.000 |
| 32 |
39 |
|
[ZN]A:448 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
12221 |
39.7 |
-19.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 33 |
40 |
|
[ZN]A:448 |
1 |
1 |
98 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
7 |
3 |
12221 |
38.2 |
-18.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 34 |
41 |
|
[MAN]A:4 |
5 |
1 |
289 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
12221 |
37.0 |
-0.1 |
0.108 |
0 |
0 |
0 |
0.000 |
| 35 |
42 |
|
[FUC]A:11 |
3 |
1 |
280 |
f |
[NAG]A:2 |
x,y,z |
1_555 |
4 |
1 |
363 |
35.4 |
1.9 |
0.302 |
0 |
0 |
0 |
0.000 |
| 36 |
43 |
|
[MAN]B:4 |
5 |
1 |
295 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
11963 |
33.7 |
-0.1 |
0.124 |
0 |
0 |
0 |
0.000 |
| 37 |
44 |
|
[FUC]A:11 |
3 |
1 |
280 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
2 |
12221 |
33.6 |
0.5 |
0.283 |
0 |
0 |
0 |
0.000 |
| 38 |
45 |
|
[BMA]A:3 |
2 |
1 |
292 |
f |
[NAG]A:8 |
x,y,z |
1_555 |
4 |
1 |
362 |
22.7 |
1.2 |
0.251 |
0 |
0 |
0 |
0.000 |
46 |
|
[BMA]B:3 |
2 |
1 |
294 |
f |
[NAG]B:8 |
x,y,z |
1_555 |
4 |
1 |
357 |
18.7 |
0.9 |
0.243 |
0 |
0 |
0 |
0.000 |
| Average: |
20.7 |
1.0 |
0.247 |
0 |
0 |
0 |
0.000 |
| 39 |
47 |
|
[NAG]B:5 |
4 |
1 |
359 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
11963 |
22.3 |
0.5 |
0.314 |
0 |
0 |
0 |
0.000 |
| 40 |
48 |
|
[MAN]A:4 |
3 |
1 |
289 |
◊ |
[BMA]B:3 |
x,y,z |
1_555 |
3 |
1 |
294 |
21.9 |
-0.1 |
0.116 |
0 |
0 |
0 |
0.000 |
| 41 |
49 |
|
[BMA]B:3 |
3 |
1 |
294 |
f |
[NAG]B:5 |
x,y,z |
1_555 |
5 |
1 |
359 |
21.2 |
0.8 |
0.153 |
0 |
0 |
0 |
0.000 |
| 42 |
50 |
|
[MAN]B:4 |
3 |
1 |
295 |
f |
[NAG]B:2 |
x,y,z |
1_555 |
2 |
1 |
364 |
20.5 |
0.7 |
0.249 |
0 |
0 |
0 |
0.000 |
51 |
|
[MAN]A:4 |
3 |
1 |
289 |
f |
[NAG]A:2 |
x,y,z |
1_555 |
2 |
1 |
363 |
16.4 |
0.5 |
0.213 |
0 |
0 |
0 |
0.000 |
| Average: |
18.5 |
0.6 |
0.231 |
0 |
0 |
0 |
0.000 |
| 43 |
52 |
|
[MAN]B:4 |
2 |
1 |
295 |
◊ |
[BMA]A:3 |
x,y,z |
1_555 |
3 |
1 |
292 |
20.4 |
-0.1 |
0.157 |
0 |
0 |
0 |
0.000 |
| 44 |
53 |
|
[BMA]A:3 |
3 |
1 |
292 |
f |
[NAG]A:5 |
x,y,z |
1_555 |
3 |
1 |
357 |
19.4 |
0.8 |
0.216 |
0 |
0 |
0 |
0.000 |
| 45 |
54 |
|
[FUC]B:11 |
2 |
1 |
280 |
f |
[MAN]B:7 |
x,y,z |
1_555 |
1 |
1 |
292 |
14.4 |
-0.1 |
0.226 |
0 |
0 |
0 |
0.000 |
| 46 |
55 |
|
[FUC]A:11 |
1 |
1 |
280 |
f |
[MAN]A:7 |
x,y,z |
1_555 |
1 |
1 |
292 |
6.2 |
-0.1 |
0.191 |
0 |
0 |
0 |
0.000 |
| 47 |
56 |
|
[MAN]B:7 |
1 |
1 |
292 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
12221 |
1.1 |
0.0 |
0.351 |
0 |
0 |
0 |
0.000 |
| 48 |
57 |
|
A |
1 |
1 |
12221 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
12221 |
0.6 |
0.0 |
0.682 |
0 |
0 |
0 |
0.000 |
| 49 |
58 |
|
[MAN]A:4 |
1 |
1 |
289 |
◊ |
[NAG]B:2 |
x,y,z |
1_555 |
1 |
1 |
364 |
0.2 |
-0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
|