| ## |
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 |
72 |
21 |
3841 |
x |
B |
z,x,y |
5_555 |
81 |
17 |
3841 |
685.1 |
-9.8 |
0.473 |
15 |
2 |
0 |
0.000 |
| 2 |
2 |
|
A |
77 |
16 |
3561 |
x |
A |
z,x,y |
5_555 |
63 |
17 |
3561 |
608.8 |
-9.7 |
0.398 |
12 |
2 |
0 |
0.000 |
| 3 |
3 |
|
A |
22 |
7 |
3561 |
◊ |
A |
-x,-y-1/2,z |
14_545 |
22 |
7 |
3561 |
205.2 |
1.1 |
0.881 |
2 |
0 |
0 |
0.000 |
| 4 |
4 |
|
A |
13 |
5 |
3561 |
◊ |
B |
-z,-x-1/2,y |
19_545 |
13 |
4 |
3841 |
121.6 |
-2.9 |
0.285 |
0 |
0 |
0 |
0.000 |
| 5 |
5 |
|
A |
10 |
4 |
3561 |
◊ |
B |
z,x,y |
5_555 |
12 |
4 |
3841 |
116.7 |
-1.6 |
0.478 |
0 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[FUC]B:101 |
10 |
1 |
281 |
◊ |
B |
z,x,y |
5_555 |
18 |
6 |
3841 |
116.4 |
1.3 |
0.341 |
0 |
0 |
0 |
0.000 |
| 7 |
7 |
|
[NAG]A:106 |
9 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
22 |
4 |
3561 |
107.1 |
1.7 |
0.397 |
0 |
0 |
0 |
0.000 |
8 |
|
[NAG]B:106 |
9 |
1 |
362 |
f |
B |
x,y,z |
1_555 |
21 |
4 |
3841 |
106.3 |
1.8 |
0.390 |
0 |
0 |
0 |
0.000 |
| Average: |
106.7 |
1.8 |
0.394 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[NAG]B:103 |
9 |
1 |
361 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
3841 |
104.9 |
3.4 |
0.549 |
2 |
0 |
0 |
0.000 |
10 |
|
[NAG]A:103 |
9 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
3561 |
87.5 |
2.9 |
0.588 |
2 |
0 |
0 |
0.000 |
| Average: |
96.2 |
3.2 |
0.568 |
2 |
0 |
0 |
0.000 |
| 9 |
11 |
|
B |
10 |
5 |
3841 |
◊ |
[C4W]A:102 |
-z,-x-1/2,y |
19_545 |
11 |
1 |
417 |
104.1 |
2.4 |
0.482 |
1 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[C4W]B:102 |
11 |
1 |
407 |
◊ |
B |
-z,-x-1/2,y |
19_545 |
14 |
4 |
3841 |
103.1 |
0.9 |
0.348 |
2 |
0 |
0 |
0.000 |
| 11 |
13 |
|
A |
17 |
6 |
3561 |
◊ |
[FUC]A:101 |
z,x,y |
5_555 |
9 |
1 |
280 |
97.7 |
1.2 |
0.411 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
B |
11 |
3 |
3841 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
3561 |
94.1 |
-1.2 |
0.540 |
0 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[GAL]B:107 |
10 |
1 |
295 |
◊ |
B |
z,x,y |
5_555 |
15 |
4 |
3841 |
85.2 |
1.6 |
0.199 |
3 |
0 |
0 |
0.000 |
16 |
|
A |
14 |
4 |
3561 |
◊ |
[GAL]A:107 |
z,x,y |
5_555 |
9 |
1 |
291 |
84.5 |
1.5 |
0.242 |
3 |
0 |
0 |
0.000 |
| Average: |
84.8 |
1.6 |
0.220 |
3 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[GAL]A:107 |
8 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
3561 |
78.5 |
0.5 |
0.217 |
0 |
0 |
0 |
0.000 |
18 |
|
[GAL]B:107 |
8 |
1 |
295 |
f |
B |
x,y,z |
1_555 |
12 |
3 |
3841 |
78.1 |
0.6 |
0.234 |
0 |
0 |
0 |
0.000 |
| Average: |
78.3 |
0.6 |
0.225 |
0 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[MAN]A:108 |
8 |
1 |
292 |
cf |
[NAG]A:109 |
x,y,z |
1_555 |
8 |
1 |
365 |
78.3 |
2.7 |
0.142 |
0 |
0 |
0 |
0.000 |
| 16 |
20 |
|
A |
11 |
4 |
3561 |
◊ |
[C4W]A:102 |
z,x,y |
5_555 |
9 |
1 |
417 |
77.4 |
-0.0 |
0.235 |
0 |
0 |
0 |
0.000 |
| 17 |
21 |
|
[FUC]B:101 |
6 |
1 |
281 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
3841 |
77.1 |
0.8 |
0.332 |
1 |
0 |
0 |
0.000 |
22 |
|
[FUC]A:101 |
7 |
1 |
280 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
3561 |
74.4 |
0.7 |
0.342 |
1 |
0 |
0 |
0.000 |
| Average: |
75.8 |
0.7 |
0.337 |
1 |
0 |
0 |
0.000 |
| 18 |
23 |
|
[MAN]B:105 |
7 |
1 |
290 |
cf |
[NAG]B:106 |
x,y,z |
1_555 |
10 |
1 |
362 |
71.9 |
2.3 |
0.105 |
0 |
0 |
0 |
0.000 |
24 |
|
[MAN]A:105 |
7 |
1 |
289 |
cf |
[NAG]A:106 |
x,y,z |
1_555 |
10 |
1 |
361 |
71.8 |
2.3 |
0.115 |
0 |
0 |
0 |
0.000 |
| Average: |
71.8 |
2.3 |
0.110 |
0 |
0 |
0 |
0.000 |
| 19 |
25 |
|
[C4W]B:102 |
8 |
1 |
407 |
◊ |
B |
z,x,y |
5_555 |
8 |
2 |
3841 |
70.1 |
-0.0 |
0.221 |
0 |
0 |
0 |
0.000 |
| 20 |
26 |
|
[NAG]B:103 |
9 |
1 |
361 |
cf |
[C4W]B:102 |
x,y,z |
1_555 |
6 |
1 |
407 |
67.0 |
1.6 |
0.124 |
0 |
0 |
0 |
0.000 |
| 21 |
27 |
|
[GAL]A:107 |
6 |
1 |
291 |
cf |
[NAG]A:106 |
x,y,z |
1_555 |
6 |
1 |
361 |
66.7 |
1.4 |
0.120 |
1 |
0 |
0 |
0.000 |
28 |
|
[GAL]B:107 |
7 |
1 |
295 |
cf |
[NAG]B:106 |
x,y,z |
1_555 |
6 |
1 |
362 |
66.6 |
1.3 |
0.107 |
1 |
0 |
0 |
0.000 |
| Average: |
66.6 |
1.3 |
0.113 |
1 |
0 |
0 |
0.000 |
| 22 |
29 |
|
B |
7 |
3 |
3841 |
◊ |
[C4W]A:102 |
y,-z,-x-1/2 |
23_554 |
8 |
1 |
417 |
63.1 |
0.2 |
0.281 |
0 |
0 |
0 |
0.000 |
| 23 |
30 |
|
[MAN]B:105 |
6 |
1 |
290 |
cf |
[BMA]B:104 |
x,y,z |
1_555 |
4 |
1 |
291 |
61.4 |
2.4 |
0.296 |
0 |
0 |
0 |
0.000 |
31 |
|
[MAN]A:105 |
6 |
1 |
289 |
cf |
[BMA]A:104 |
x,y,z |
1_555 |
5 |
1 |
290 |
59.2 |
2.4 |
0.247 |
0 |
0 |
0 |
0.000 |
| Average: |
60.3 |
2.4 |
0.272 |
0 |
0 |
0 |
0.000 |
| 24 |
32 |
|
[BMA]B:104 |
7 |
1 |
291 |
cf |
[NAG]B:103 |
x,y,z |
1_555 |
6 |
1 |
361 |
60.4 |
1.2 |
0.099 |
0 |
0 |
0 |
0.000 |
| 25 |
33 |
|
B |
8 |
3 |
3841 |
◊ |
[NAG]A:103 |
y,-z,-x-1/2 |
23_554 |
8 |
1 |
361 |
58.4 |
0.2 |
0.227 |
2 |
0 |
0 |
0.000 |
| 26 |
34 |
|
[MAN]A:108 |
7 |
1 |
292 |
cf |
[BMA]A:104 |
x,y,z |
1_555 |
5 |
1 |
290 |
57.4 |
2.7 |
0.253 |
0 |
0 |
0 |
0.000 |
| 27 |
35 |
|
[NAG]A:103 |
10 |
1 |
361 |
cf |
[C4W]A:102 |
x,y,z |
1_555 |
7 |
1 |
417 |
57.3 |
1.4 |
0.105 |
0 |
0 |
0 |
0.000 |
| 28 |
36 |
|
B |
5 |
2 |
3841 |
◊ |
A |
-x,-y-1/2,z |
14_545 |
7 |
3 |
3561 |
52.5 |
0.7 |
0.588 |
0 |
0 |
0 |
0.000 |
| 29 |
37 |
|
[BMA]A:104 |
7 |
1 |
290 |
cf |
[NAG]A:103 |
x,y,z |
1_555 |
6 |
1 |
361 |
52.5 |
1.0 |
0.099 |
0 |
0 |
0 |
0.000 |
| 30 |
38 |
|
[C4W]A:102 |
11 |
1 |
417 |
◊ |
B |
-x-1/2,y,-z |
15_455 |
4 |
3 |
3841 |
49.3 |
-1.3 |
0.033 |
0 |
0 |
0 |
0.000 |
| 31 |
39 |
|
[C4W]B:102 |
4 |
1 |
407 |
cf |
[FUC]B:101 |
x,y,z |
1_555 |
6 |
1 |
281 |
45.2 |
2.0 |
0.320 |
0 |
0 |
0 |
0.000 |
| 32 |
40 |
|
[MAN]B:105 |
5 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
9 |
2 |
3841 |
44.7 |
0.9 |
0.411 |
0 |
0 |
0 |
0.000 |
41 |
|
[MAN]A:105 |
5 |
1 |
289 |
f |
A |
x,y,z |
1_555 |
9 |
2 |
3561 |
44.1 |
0.9 |
0.406 |
0 |
0 |
0 |
0.000 |
| Average: |
44.4 |
0.9 |
0.409 |
0 |
0 |
0 |
0.000 |
| 33 |
42 |
|
[BMA]B:104 |
5 |
1 |
291 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
3841 |
43.3 |
0.1 |
0.276 |
0 |
0 |
0 |
0.000 |
43 |
|
[BMA]A:104 |
5 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
3561 |
33.1 |
0.1 |
0.265 |
0 |
0 |
0 |
0.000 |
| Average: |
38.2 |
0.1 |
0.271 |
0 |
0 |
0 |
0.000 |
| 34 |
44 |
|
[FUC]A:101 |
4 |
1 |
280 |
◊ |
B |
-x-1/2,y,-z |
15_455 |
8 |
3 |
3841 |
42.5 |
0.4 |
0.455 |
1 |
0 |
0 |
0.000 |
| 35 |
45 |
|
[C4W]A:102 |
5 |
1 |
417 |
cf |
[FUC]A:101 |
x,y,z |
1_555 |
6 |
1 |
280 |
42.3 |
1.8 |
0.283 |
0 |
0 |
0 |
0.000 |
| 36 |
46 |
|
[C4W]B:102 |
6 |
1 |
407 |
◊ |
[C4W]B:102 |
-x,-y-1/2,z |
14_545 |
6 |
1 |
407 |
38.8 |
0.2 |
0.107 |
0 |
0 |
0 |
0.000 |
| 37 |
47 |
|
[NAG]B:103 |
5 |
1 |
361 |
f |
[FUC]B:101 |
x,y,z |
1_555 |
4 |
1 |
281 |
36.3 |
1.8 |
0.240 |
0 |
0 |
0 |
0.000 |
48 |
|
[NAG]A:103 |
5 |
1 |
361 |
f |
[FUC]A:101 |
x,y,z |
1_555 |
4 |
1 |
280 |
29.5 |
1.3 |
0.299 |
0 |
0 |
0 |
0.000 |
| Average: |
32.9 |
1.5 |
0.269 |
0 |
0 |
0 |
0.000 |
| 38 |
49 |
|
B |
5 |
1 |
3841 |
◊ |
[BMA]A:104 |
y,-z,-x-1/2 |
23_554 |
5 |
1 |
290 |
35.7 |
1.1 |
0.448 |
0 |
0 |
0 |
0.000 |
| 39 |
50 |
|
B |
2 |
1 |
3841 |
◊ |
[NAG]A:103 |
-z,-x-1/2,y |
19_545 |
5 |
1 |
361 |
35.6 |
1.3 |
0.439 |
2 |
0 |
0 |
0.000 |
| 40 |
51 |
|
B |
4 |
1 |
3841 |
◊ |
A |
-x-1/2,y,-z |
15_455 |
3 |
1 |
3561 |
35.4 |
0.5 |
0.812 |
1 |
2 |
0 |
0.000 |
| 41 |
52 |
|
A |
3 |
1 |
3561 |
x |
A |
-z,-x-1/2,y |
19_545 |
3 |
1 |
3561 |
35.3 |
1.0 |
0.833 |
2 |
0 |
0 |
0.000 |
| 42 |
53 |
|
B |
5 |
2 |
3841 |
◊ |
B |
-x-1/2,y,-z |
15_455 |
5 |
2 |
3841 |
33.5 |
-1.0 |
0.369 |
0 |
0 |
0 |
0.000 |
| 43 |
54 |
|
[C4W]B:102 |
2 |
1 |
407 |
◊ |
B |
-x,-y-1/2,z |
14_545 |
6 |
1 |
3841 |
31.7 |
1.1 |
0.771 |
0 |
0 |
0 |
0.000 |
| 44 |
55 |
|
[C4W]B:102 |
4 |
1 |
407 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
3841 |
28.5 |
0.6 |
0.459 |
0 |
0 |
0 |
0.000 |
| 45 |
56 |
|
[NAG]B:103 |
3 |
1 |
361 |
◊ |
B |
z,x,y |
5_555 |
3 |
1 |
3841 |
28.2 |
0.4 |
0.339 |
0 |
0 |
0 |
0.000 |
| 46 |
57 |
|
[C4W]A:102 |
5 |
1 |
417 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
3561 |
27.8 |
0.6 |
0.419 |
0 |
0 |
0 |
0.000 |
| 47 |
58 |
|
A |
3 |
1 |
3561 |
◊ |
[NAG]A:103 |
z,x,y |
5_555 |
4 |
1 |
361 |
26.7 |
0.2 |
0.246 |
0 |
0 |
0 |
0.000 |
| 48 |
59 |
|
[BMA]A:104 |
4 |
1 |
290 |
f |
[NAG]A:109 |
x,y,z |
1_555 |
4 |
1 |
365 |
22.9 |
1.1 |
0.194 |
0 |
0 |
0 |
0.000 |
| 49 |
60 |
|
[BMA]A:104 |
2 |
1 |
290 |
f |
[NAG]A:106 |
x,y,z |
1_555 |
3 |
1 |
361 |
20.0 |
1.1 |
0.275 |
0 |
0 |
0 |
0.000 |
61 |
|
[BMA]B:104 |
2 |
1 |
291 |
f |
[NAG]B:106 |
x,y,z |
1_555 |
3 |
1 |
362 |
19.1 |
1.0 |
0.272 |
0 |
0 |
0 |
0.000 |
| Average: |
19.5 |
1.0 |
0.274 |
0 |
0 |
0 |
0.000 |
| 50 |
62 |
|
[MAN]A:108 |
3 |
1 |
292 |
f |
[NAG]A:103 |
x,y,z |
1_555 |
2 |
1 |
361 |
15.8 |
0.4 |
0.216 |
0 |
0 |
0 |
0.000 |
| 51 |
63 |
|
[MAN]A:105 |
2 |
1 |
289 |
f |
[NAG]A:103 |
x,y,z |
1_555 |
1 |
1 |
361 |
9.3 |
0.4 |
0.307 |
0 |
0 |
0 |
0.000 |
| 52 |
64 |
|
[MAN]B:105 |
1 |
1 |
290 |
f |
[NAG]B:103 |
x,y,z |
1_555 |
1 |
1 |
361 |
7.8 |
0.3 |
0.279 |
0 |
0 |
0 |
0.000 |
| 53 |
65 |
|
[FUC]B:101 |
1 |
1 |
281 |
◊ |
B |
-z,-x-1/2,y |
19_545 |
3 |
1 |
3841 |
4.8 |
0.0 |
0.355 |
0 |
0 |
0 |
0.000 |
| 54 |
66 |
|
[NAG]B:106 |
1 |
1 |
362 |
◊ |
B |
z,x,y |
5_555 |
1 |
1 |
3841 |
4.0 |
-0.0 |
0.322 |
0 |
0 |
0 |
0.000 |
67 |
|
A |
1 |
1 |
3561 |
◊ |
[NAG]A:106 |
z,x,y |
5_555 |
1 |
1 |
361 |
3.2 |
-0.0 |
0.325 |
0 |
0 |
0 |
0.000 |
| Average: |
3.6 |
-0.0 |
0.324 |
0 |
0 |
0 |
0.000 |
| 55 |
68 |
|
[NAG]B:103 |
1 |
1 |
361 |
◊ |
B |
-z,-x-1/2,y |
19_545 |
1 |
1 |
3841 |
2.9 |
0.1 |
0.386 |
0 |
0 |
0 |
0.000 |
| 56 |
69 |
|
B |
1 |
1 |
3841 |
◊ |
[MAN]A:105 |
y,-z,-x-1/2 |
23_554 |
1 |
1 |
289 |
1.1 |
0.0 |
0.356 |
0 |
0 |
0 |
0.000 |
| 57 |
70 |
|
B |
1 |
1 |
3841 |
◊ |
A |
-z,-x-1/2,y |
19_545 |
1 |
1 |
3561 |
0.6 |
0.0 |
0.704 |
0 |
0 |
0 |
0.000 |
| 58 |
71 |
|
B |
1 |
1 |
3841 |
◊ |
A |
y,-z,-x-1/2 |
23_554 |
1 |
1 |
3561 |
0.3 |
0.0 |
0.679 |
0 |
0 |
0 |
0.000 |
|