| ## |
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 |
120 |
32 |
11844 |
◊ |
A |
x,y,z |
1_555 |
119 |
32 |
11645 |
1136.1 |
-15.3 |
0.055 |
11 |
4 |
0 |
0.000 |
| 2 |
2 |
|
B |
59 |
18 |
11844 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
58 |
17 |
11645 |
484.8 |
-0.5 |
0.604 |
4 |
1 |
0 |
0.000 |
| 3 |
3 |
|
B |
43 |
14 |
11844 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
40 |
12 |
11645 |
417.2 |
1.7 |
0.767 |
8 |
3 |
0 |
0.000 |
| 4 |
4 |
|
A |
37 |
11 |
11645 |
x |
A |
x-1,y,z |
1_455 |
38 |
11 |
11645 |
321.0 |
-0.9 |
0.539 |
5 |
0 |
0 |
0.000 |
| 5 |
5 |
|
B |
33 |
11 |
11844 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
37 |
13 |
11645 |
306.6 |
0.1 |
0.632 |
4 |
0 |
0 |
0.000 |
| 6 |
6 |
|
B |
28 |
10 |
11844 |
x |
B |
x-1,y,z |
1_455 |
26 |
8 |
11844 |
231.4 |
-1.2 |
0.465 |
2 |
0 |
0 |
0.000 |
| 7 |
7 |
|
[NAG]A:101 |
12 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
19 |
7 |
11645 |
156.9 |
3.8 |
0.369 |
1 |
0 |
0 |
0.000 |
| 8 |
8 |
|
[NAG]B:201 |
12 |
1 |
361 |
cf |
B |
x,y,z |
1_555 |
20 |
7 |
11844 |
154.5 |
3.6 |
0.380 |
1 |
0 |
0 |
0.000 |
| 9 |
9 |
|
B |
19 |
7 |
11844 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
5 |
11645 |
135.5 |
1.9 |
0.829 |
2 |
1 |
0 |
0.000 |
| 10 |
10 |
|
[NAG]B:206 |
10 |
1 |
356 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
11844 |
130.1 |
1.8 |
0.223 |
1 |
0 |
0 |
0.000 |
| 11 |
11 |
|
[NAG]A:106 |
10 |
1 |
354 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
11645 |
121.7 |
1.6 |
0.203 |
1 |
0 |
0 |
0.000 |
| 12 |
12 |
|
A |
12 |
4 |
11645 |
x |
A |
-x,y-1/2,-z |
2_545 |
12 |
3 |
11645 |
115.6 |
0.8 |
0.599 |
1 |
0 |
0 |
0.000 |
| 13 |
13 |
|
[NAG]A:103 |
11 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
11645 |
113.0 |
2.1 |
0.258 |
1 |
0 |
0 |
0.000 |
| 14 |
14 |
|
[NAG]B:203 |
11 |
1 |
359 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
11844 |
105.8 |
1.7 |
0.253 |
1 |
0 |
0 |
0.000 |
| 15 |
15 |
|
B |
12 |
4 |
11844 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
14 |
5 |
11844 |
83.2 |
-0.1 |
0.574 |
0 |
0 |
0 |
0.000 |
| 16 |
16 |
|
B |
12 |
4 |
11844 |
x |
B |
-x,y-1/2,-z |
2_545 |
7 |
2 |
11844 |
82.6 |
0.3 |
0.660 |
1 |
0 |
0 |
0.000 |
| 17 |
17 |
|
[BMA]A:104 |
7 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
11645 |
71.6 |
1.0 |
0.171 |
0 |
0 |
0 |
0.000 |
| 18 |
18 |
|
[BMA]B:204 |
7 |
1 |
294 |
f |
B |
x,y,z |
1_555 |
9 |
2 |
11844 |
70.8 |
1.0 |
0.198 |
0 |
0 |
0 |
0.000 |
| 19 |
19 |
|
[MAN]B:208 |
7 |
1 |
292 |
cf |
[NAG]B:209 |
x,y,z |
1_555 |
8 |
1 |
357 |
69.9 |
2.0 |
0.106 |
0 |
0 |
0 |
0.000 |
20 |
|
[MAN]A:108 |
7 |
1 |
292 |
cf |
[NAG]A:109 |
x,y,z |
1_555 |
7 |
1 |
360 |
69.2 |
2.0 |
0.128 |
0 |
0 |
0 |
0.000 |
| Average: |
69.5 |
2.0 |
0.117 |
0 |
0 |
0 |
0.000 |
| 20 |
21 |
|
[MAN]B:205 |
7 |
1 |
291 |
cf |
[NAG]B:206 |
x,y,z |
1_555 |
7 |
1 |
356 |
68.7 |
2.2 |
0.121 |
1 |
0 |
0 |
0.000 |
22 |
|
[MAN]A:105 |
7 |
1 |
289 |
cf |
[NAG]A:106 |
x,y,z |
1_555 |
7 |
1 |
354 |
66.8 |
2.1 |
0.121 |
1 |
0 |
0 |
0.000 |
| Average: |
67.8 |
2.2 |
0.121 |
1 |
0 |
0 |
0.000 |
| 21 |
23 |
|
[NAG]A:103 |
10 |
1 |
360 |
cf |
[NAG]A:101 |
x,y,z |
1_555 |
5 |
1 |
361 |
65.3 |
1.3 |
0.076 |
0 |
0 |
0 |
0.000 |
24 |
|
[NAG]B:203 |
9 |
1 |
359 |
cf |
[NAG]B:201 |
x,y,z |
1_555 |
5 |
1 |
361 |
61.8 |
1.2 |
0.089 |
0 |
0 |
0 |
0.000 |
| Average: |
63.5 |
1.2 |
0.082 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
[FUC]B:202 |
6 |
1 |
278 |
◊ |
[NAG]A:109 |
x,y,z |
1_555 |
8 |
1 |
360 |
59.7 |
1.2 |
0.100 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[BMA]A:104 |
6 |
1 |
292 |
cf |
[NAG]A:103 |
x,y,z |
1_555 |
7 |
1 |
360 |
59.7 |
1.2 |
0.096 |
1 |
0 |
0 |
0.000 |
27 |
|
[BMA]B:204 |
6 |
1 |
294 |
cf |
[NAG]B:203 |
x,y,z |
1_555 |
7 |
1 |
359 |
57.1 |
1.3 |
0.101 |
1 |
0 |
0 |
0.000 |
| Average: |
58.4 |
1.2 |
0.098 |
1 |
0 |
0 |
0.000 |
| 24 |
28 |
|
[FUL]A:102 |
6 |
1 |
281 |
cf |
[NAG]A:101 |
x,y,z |
1_555 |
5 |
1 |
361 |
57.8 |
1.7 |
0.172 |
0 |
0 |
0 |
0.000 |
| 25 |
29 |
|
[FUC]B:202 |
6 |
1 |
278 |
cf |
[NAG]B:201 |
x,y,z |
1_555 |
5 |
1 |
361 |
57.5 |
1.7 |
0.178 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
[MAN]B:208 |
7 |
1 |
292 |
cf |
[BMA]B:204 |
x,y,z |
1_555 |
6 |
1 |
294 |
56.8 |
2.5 |
0.179 |
0 |
0 |
0 |
0.000 |
31 |
|
[MAN]A:108 |
7 |
1 |
292 |
cf |
[BMA]A:104 |
x,y,z |
1_555 |
6 |
1 |
292 |
54.6 |
2.4 |
0.175 |
0 |
0 |
0 |
0.000 |
| Average: |
55.7 |
2.4 |
0.177 |
0 |
0 |
0 |
0.000 |
| 27 |
32 |
|
[MAN]B:205 |
6 |
1 |
291 |
cf |
[BMA]B:204 |
x,y,z |
1_555 |
3 |
1 |
294 |
54.0 |
2.0 |
0.272 |
0 |
0 |
0 |
0.000 |
33 |
|
[MAN]A:105 |
6 |
1 |
289 |
cf |
[BMA]A:104 |
x,y,z |
1_555 |
3 |
1 |
292 |
52.0 |
2.0 |
0.270 |
0 |
0 |
0 |
0.000 |
| Average: |
53.0 |
2.0 |
0.271 |
0 |
0 |
0 |
0.000 |
| 28 |
34 |
|
[MAN]A:105 |
6 |
1 |
289 |
f |
[NAG]A:103 |
x,y,z |
1_555 |
5 |
1 |
360 |
54.0 |
2.0 |
0.210 |
0 |
0 |
0 |
0.000 |
35 |
|
[MAN]B:205 |
6 |
1 |
291 |
f |
[NAG]B:203 |
x,y,z |
1_555 |
5 |
1 |
359 |
51.0 |
1.9 |
0.210 |
0 |
0 |
0 |
0.000 |
| Average: |
52.5 |
1.9 |
0.210 |
0 |
0 |
0 |
0.000 |
| 29 |
36 |
|
[MAN]B:205 |
5 |
1 |
291 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
11844 |
51.8 |
1.6 |
0.443 |
0 |
0 |
0 |
0.000 |
| 30 |
37 |
|
[MAN]A:108 |
5 |
1 |
292 |
◊ |
[NAG]B:201 |
x,y,z |
1_555 |
4 |
1 |
361 |
50.8 |
1.2 |
0.176 |
0 |
0 |
0 |
0.000 |
| 31 |
38 |
|
[FUC]B:202 |
3 |
1 |
278 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
11844 |
48.8 |
1.6 |
0.666 |
1 |
0 |
0 |
0.000 |
| 32 |
39 |
|
[MAN]A:105 |
4 |
1 |
289 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
11645 |
48.2 |
1.5 |
0.467 |
0 |
0 |
0 |
0.000 |
| 33 |
40 |
|
[FUL]A:102 |
4 |
1 |
281 |
f |
[NAG]A:103 |
x,y,z |
1_555 |
6 |
1 |
360 |
48.1 |
2.2 |
0.267 |
1 |
0 |
0 |
0.000 |
| 34 |
41 |
|
[FUL]A:102 |
3 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
11645 |
47.2 |
1.5 |
0.665 |
1 |
0 |
0 |
0.000 |
| 35 |
42 |
|
[FUC]B:202 |
4 |
1 |
278 |
f |
[NAG]B:203 |
x,y,z |
1_555 |
7 |
1 |
359 |
45.5 |
2.0 |
0.238 |
1 |
0 |
0 |
0.000 |
| 36 |
43 |
|
[MAN]A:108 |
6 |
1 |
292 |
◊ |
[NAG]B:203 |
x,y,z |
1_555 |
6 |
1 |
359 |
41.1 |
0.5 |
0.078 |
1 |
0 |
0 |
0.000 |
| 37 |
44 |
|
[FUC]B:202 |
3 |
1 |
278 |
◊ |
[MAN]A:108 |
x,y,z |
1_555 |
4 |
1 |
292 |
37.2 |
0.5 |
0.131 |
0 |
0 |
0 |
0.000 |
| 38 |
45 |
|
[MAN]A:108 |
5 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
11645 |
30.0 |
-0.0 |
0.124 |
0 |
0 |
0 |
0.000 |
| 39 |
46 |
|
[MAN]B:208 |
5 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
11844 |
25.7 |
-0.1 |
0.157 |
0 |
0 |
0 |
0.000 |
| 40 |
47 |
|
[BMA]A:104 |
3 |
1 |
292 |
f |
[NAG]A:109 |
x,y,z |
1_555 |
2 |
1 |
360 |
23.7 |
0.8 |
0.262 |
0 |
0 |
0 |
0.000 |
48 |
|
[BMA]B:204 |
3 |
1 |
294 |
f |
[NAG]B:209 |
x,y,z |
1_555 |
2 |
1 |
357 |
23.4 |
0.8 |
0.266 |
0 |
0 |
0 |
0.000 |
| Average: |
23.6 |
0.8 |
0.264 |
0 |
0 |
0 |
0.000 |
| 41 |
49 |
|
[NAG]A:109 |
3 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
11645 |
23.3 |
0.5 |
0.375 |
0 |
0 |
0 |
0.000 |
| 42 |
50 |
|
[MAN]A:105 |
3 |
1 |
289 |
f |
[FUL]A:102 |
x,y,z |
1_555 |
2 |
1 |
281 |
20.3 |
0.4 |
0.151 |
0 |
0 |
0 |
0.000 |
| 43 |
51 |
|
[FUC]B:202 |
2 |
1 |
278 |
f |
[MAN]B:205 |
x,y,z |
1_555 |
3 |
1 |
291 |
20.2 |
0.4 |
0.151 |
0 |
0 |
0 |
0.000 |
| 44 |
52 |
|
[BMA]B:204 |
2 |
1 |
294 |
f |
[NAG]B:206 |
x,y,z |
1_555 |
1 |
1 |
356 |
15.7 |
0.7 |
0.456 |
0 |
0 |
0 |
0.000 |
53 |
|
[BMA]A:104 |
2 |
1 |
292 |
f |
[NAG]A:106 |
x,y,z |
1_555 |
1 |
1 |
354 |
15.7 |
0.7 |
0.456 |
0 |
0 |
0 |
0.000 |
| Average: |
15.7 |
0.7 |
0.456 |
0 |
0 |
0 |
0.000 |
| 45 |
54 |
|
[NAG]B:209 |
3 |
1 |
357 |
f |
B |
x,y,z |
1_555 |
3 |
2 |
11844 |
10.1 |
0.2 |
0.298 |
0 |
0 |
0 |
0.000 |
| 46 |
55 |
|
[MAN]A:108 |
4 |
1 |
292 |
f |
[NAG]A:103 |
x,y,z |
1_555 |
3 |
1 |
360 |
6.7 |
0.2 |
0.151 |
0 |
0 |
0 |
0.000 |
56 |
|
[MAN]B:208 |
3 |
1 |
292 |
f |
[NAG]B:203 |
x,y,z |
1_555 |
3 |
1 |
359 |
6.5 |
0.2 |
0.188 |
0 |
0 |
0 |
0.000 |
| Average: |
6.6 |
0.2 |
0.170 |
0 |
0 |
0 |
0.000 |
| 47 |
57 |
|
[NAG]B:201 |
1 |
1 |
361 |
◊ |
[NAG]A:109 |
x,y,z |
1_555 |
1 |
1 |
360 |
4.3 |
0.1 |
0.143 |
0 |
0 |
0 |
0.000 |
| 48 |
58 |
|
[BMA]A:104 |
2 |
1 |
292 |
◊ |
[NAG]B:203 |
x,y,z |
1_555 |
1 |
1 |
359 |
3.2 |
0.1 |
0.188 |
0 |
0 |
0 |
0.000 |
| 49 |
59 |
|
[MAN]B:205 |
1 |
1 |
291 |
◊ |
[NAG]A:109 |
x,y,z |
1_555 |
1 |
1 |
360 |
0.8 |
0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
|