| ## |
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 |
|
A |
44 |
17 |
31847 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
47 |
17 |
31847 |
414.0 |
-2.1 |
0.382 |
6 |
0 |
0 |
0.000 |
| 2 |
2 |
|
A |
34 |
11 |
31847 |
x |
A |
-x,y-1/2,-z-1/2 |
3_544 |
40 |
12 |
31847 |
288.6 |
-1.4 |
0.492 |
1 |
0 |
0 |
0.000 |
| 3 |
3 |
|
A |
20 |
6 |
31847 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
27 |
10 |
31847 |
221.9 |
0.3 |
0.664 |
2 |
2 |
0 |
0.000 |
| 4 |
4 |
|
[NAG]A:1760 |
14 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
28 |
11 |
31847 |
205.3 |
6.6 |
0.579 |
2 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[NAG]A:1373 |
12 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
30 |
13 |
31847 |
199.3 |
4.8 |
0.467 |
5 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[NAG]A:1914 |
12 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
29 |
13 |
31847 |
186.8 |
5.6 |
0.585 |
2 |
0 |
0 |
0.000 |
| 7 |
7 |
|
[GAL]A:4000 |
12 |
1 |
306 |
f |
A |
x,y,z |
1_555 |
32 |
13 |
31847 |
167.2 |
3.9 |
0.605 |
10 |
0 |
0 |
0.000 |
| 8 |
8 |
|
[NAG]A:1622 |
13 |
1 |
365 |
cf |
A |
x,y,z |
1_555 |
19 |
9 |
31847 |
164.3 |
4.0 |
0.387 |
1 |
0 |
0 |
0.000 |
| 9 |
9 |
|
[GLC]A:4001 |
11 |
1 |
288 |
f |
A |
x,y,z |
1_555 |
28 |
11 |
31847 |
154.7 |
1.3 |
0.289 |
0 |
0 |
0 |
0.000 |
| 10 |
10 |
|
A |
29 |
9 |
31847 |
◊ |
[NAG]A:1739 |
x-1/2,-y-1/2,-z |
4_445 |
10 |
1 |
362 |
152.6 |
2.6 |
0.396 |
4 |
0 |
0 |
0.000 |
| 11 |
11 |
|
[NAG]A:1374 |
11 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
24 |
12 |
31847 |
148.0 |
2.1 |
0.179 |
0 |
0 |
0 |
0.000 |
| 12 |
12 |
|
[NAG]A:1623 |
12 |
1 |
365 |
f |
A |
x,y,z |
1_555 |
24 |
7 |
31847 |
140.5 |
3.6 |
0.389 |
0 |
0 |
0 |
0.000 |
| 13 |
13 |
|
[NAG]A:1478 |
11 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
15 |
5 |
31847 |
131.0 |
3.4 |
0.424 |
0 |
0 |
0 |
0.000 |
| 14 |
14 |
|
[NAG]A:1777 |
10 |
1 |
365 |
cf |
A |
x,y,z |
1_555 |
16 |
6 |
31847 |
125.9 |
5.2 |
0.615 |
1 |
0 |
0 |
0.000 |
| 15 |
15 |
|
[NAG]A:1156 |
7 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
16 |
5 |
31847 |
113.4 |
3.6 |
0.657 |
0 |
0 |
0 |
0.000 |
| 16 |
16 |
|
[DMS]A:3007 |
4 |
1 |
205 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
31847 |
112.5 |
2.4 |
0.454 |
1 |
0 |
0 |
0.000 |
| 17 |
17 |
|
A |
14 |
3 |
31847 |
x |
A |
x-1/2,-y-1/2,-z-1 |
4_444 |
13 |
4 |
31847 |
109.7 |
0.3 |
0.657 |
1 |
1 |
0 |
0.000 |
| 18 |
18 |
|
[NAG]A:1522 |
10 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
10 |
6 |
31847 |
106.7 |
3.6 |
0.436 |
1 |
0 |
0 |
0.000 |
| 19 |
19 |
|
[MAN]A:1376 |
7 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
31847 |
102.9 |
0.7 |
0.270 |
0 |
0 |
0 |
0.000 |
| 20 |
20 |
|
[NAG]A:1915 |
9 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
31847 |
98.7 |
1.9 |
0.347 |
1 |
0 |
0 |
0.000 |
| 21 |
21 |
|
[MAN]A:1626 |
8 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
31847 |
98.0 |
2.8 |
0.361 |
3 |
0 |
0 |
0.000 |
| 22 |
22 |
|
[MAN]A:1917 |
9 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
31847 |
91.1 |
0.4 |
0.150 |
1 |
0 |
0 |
0.000 |
| 23 |
23 |
|
[DMS]A:3004 |
4 |
1 |
206 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
31847 |
88.4 |
1.4 |
0.359 |
0 |
0 |
0 |
0.000 |
| 24 |
24 |
|
[MAN]A:1627 |
8 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
31847 |
86.4 |
0.6 |
0.235 |
2 |
0 |
0 |
0.000 |
| 25 |
25 |
|
[DMS]A:3005 |
4 |
1 |
206 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
31847 |
81.6 |
1.2 |
0.443 |
1 |
0 |
0 |
0.000 |
| 26 |
26 |
|
[SO4]A:2001 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
31847 |
75.7 |
-10.7 |
0.772 |
2 |
0 |
0 |
0.000 |
| 27 |
27 |
|
[NAG]A:1623 |
8 |
1 |
365 |
cf |
[NAG]A:1622 |
x,y,z |
1_555 |
6 |
1 |
365 |
74.9 |
1.6 |
0.110 |
1 |
0 |
0 |
0.000 |
28 |
|
[NAG]A:1915 |
10 |
1 |
363 |
cf |
[NAG]A:1914 |
x,y,z |
1_555 |
6 |
1 |
360 |
73.6 |
1.8 |
0.091 |
0 |
0 |
0 |
0.000 |
29 |
|
[NAG]A:1374 |
9 |
1 |
363 |
cf |
[NAG]A:1373 |
x,y,z |
1_555 |
6 |
1 |
362 |
73.2 |
1.7 |
0.094 |
0 |
0 |
0 |
0.000 |
| Average: |
73.9 |
1.7 |
0.098 |
0 |
0 |
0 |
0.000 |
| 28 |
30 |
|
[NAG]A:1522 |
9 |
1 |
363 |
◊ |
A |
x-1/2,-y-1/2,-z-1 |
4_444 |
8 |
2 |
31847 |
72.5 |
1.3 |
0.238 |
1 |
0 |
0 |
0.000 |
| 29 |
31 |
|
[MAN]A:1625 |
9 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
31847 |
70.9 |
2.0 |
0.304 |
2 |
0 |
0 |
0.000 |
| 30 |
32 |
|
[CL]A:2003 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
31847 |
69.5 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 31 |
33 |
|
[MAN]A:1919 |
8 |
1 |
296 |
cf |
[MAN]A:1918 |
x,y,z |
1_555 |
7 |
1 |
291 |
68.1 |
2.6 |
0.159 |
0 |
0 |
0 |
0.000 |
| 32 |
34 |
|
[MAN]A:1629 |
5 |
1 |
292 |
◊ |
A |
-x+1,y-1/2,-z-1/2 |
3_644 |
7 |
2 |
31847 |
67.2 |
1.7 |
0.458 |
3 |
0 |
0 |
0.000 |
| 33 |
35 |
|
[MAN]A:1628 |
7 |
1 |
294 |
cf |
[MAN]A:1627 |
x,y,z |
1_555 |
8 |
1 |
294 |
66.8 |
2.4 |
0.145 |
1 |
0 |
0 |
0.000 |
| 34 |
36 |
|
[MAN]A:1629 |
7 |
1 |
292 |
cf |
[MAN]A:1628 |
x,y,z |
1_555 |
7 |
1 |
294 |
65.4 |
2.1 |
0.142 |
0 |
0 |
0 |
0.000 |
| 35 |
37 |
|
[MAN]A:1918 |
4 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
31847 |
64.6 |
0.2 |
0.173 |
0 |
0 |
0 |
0.000 |
| 36 |
38 |
|
[MAN]A:1918 |
6 |
1 |
291 |
cf |
[MAN]A:1917 |
x,y,z |
1_555 |
7 |
1 |
292 |
59.9 |
2.5 |
0.200 |
0 |
0 |
0 |
0.000 |
| 37 |
39 |
|
[BMA]A:1375 |
7 |
1 |
294 |
cf |
[NAG]A:1374 |
x,y,z |
1_555 |
5 |
1 |
363 |
59.5 |
1.0 |
0.102 |
0 |
0 |
0 |
0.000 |
| 38 |
40 |
|
[BMA]A:1916 |
5 |
1 |
296 |
cf |
[NAG]A:1915 |
x,y,z |
1_555 |
5 |
1 |
363 |
59.3 |
1.1 |
0.144 |
0 |
0 |
0 |
0.000 |
41 |
|
[BMA]A:1624 |
7 |
1 |
291 |
cf |
[NAG]A:1623 |
x,y,z |
1_555 |
4 |
1 |
365 |
56.7 |
0.9 |
0.121 |
0 |
0 |
0 |
0.000 |
| Average: |
58.0 |
1.0 |
0.132 |
0 |
0 |
0 |
0.000 |
| 39 |
42 |
|
[NAG]A:1739 |
9 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
6 |
2 |
31847 |
59.3 |
1.7 |
0.282 |
0 |
0 |
0 |
0.000 |
| 40 |
43 |
|
[MAN]A:1377 |
7 |
1 |
295 |
cf |
[MAN]A:1376 |
x,y,z |
1_555 |
7 |
1 |
294 |
58.7 |
2.8 |
0.174 |
0 |
0 |
0 |
0.000 |
| 41 |
44 |
|
[MAN]A:1376 |
6 |
1 |
294 |
cf |
[BMA]A:1375 |
x,y,z |
1_555 |
7 |
1 |
294 |
58.4 |
2.5 |
0.194 |
0 |
0 |
0 |
0.000 |
| 42 |
45 |
|
[MAN]A:1626 |
6 |
1 |
295 |
cf |
[MAN]A:1625 |
x,y,z |
1_555 |
5 |
1 |
295 |
57.8 |
2.6 |
0.261 |
0 |
0 |
0 |
0.000 |
| 43 |
46 |
|
[MAN]A:1627 |
7 |
1 |
294 |
cf |
[BMA]A:1624 |
x,y,z |
1_555 |
5 |
1 |
291 |
56.8 |
2.5 |
0.245 |
0 |
0 |
0 |
0.000 |
| 44 |
47 |
|
[MAN]A:1625 |
6 |
1 |
295 |
cf |
[BMA]A:1624 |
x,y,z |
1_555 |
6 |
1 |
291 |
56.8 |
2.4 |
0.211 |
0 |
0 |
0 |
0.000 |
| 45 |
48 |
|
[MAN]A:1917 |
6 |
1 |
292 |
cf |
[BMA]A:1916 |
x,y,z |
1_555 |
5 |
1 |
296 |
55.3 |
2.3 |
0.221 |
0 |
0 |
0 |
0.000 |
| 46 |
49 |
|
[GLC]A:4001 |
5 |
1 |
288 |
cf |
[GAL]A:4000 |
x,y,z |
1_555 |
6 |
1 |
306 |
55.2 |
1.5 |
0.200 |
0 |
0 |
0 |
0.000 |
| 47 |
50 |
|
[BMA]A:1916 |
7 |
1 |
296 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
31847 |
51.4 |
0.2 |
0.148 |
0 |
0 |
0 |
0.000 |
| 48 |
51 |
|
A |
3 |
2 |
31847 |
◊ |
[SO4]A:2001 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
186 |
46.2 |
-5.2 |
0.860 |
1 |
0 |
0 |
0.000 |
| 49 |
52 |
|
[BMA]A:1375 |
4 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
31847 |
44.0 |
1.0 |
0.462 |
1 |
0 |
0 |
0.000 |
| 50 |
53 |
|
[GLC]A:4001 |
5 |
1 |
288 |
◊ |
[NAG]A:1739 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
362 |
43.4 |
1.8 |
0.279 |
0 |
0 |
0 |
0.000 |
| 51 |
54 |
|
[BMA]A:1624 |
7 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
31847 |
41.1 |
0.7 |
0.237 |
0 |
0 |
0 |
0.000 |
| 52 |
55 |
|
[MAN]A:1626 |
5 |
1 |
295 |
f |
[BMA]A:1624 |
x,y,z |
1_555 |
5 |
1 |
291 |
39.8 |
1.4 |
0.161 |
0 |
0 |
0 |
0.000 |
| 53 |
56 |
|
[MAN]A:1628 |
5 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
31847 |
34.9 |
0.5 |
0.297 |
0 |
0 |
0 |
0.000 |
| 54 |
57 |
|
[MAN]A:1377 |
5 |
1 |
295 |
f |
[BMA]A:1375 |
x,y,z |
1_555 |
3 |
1 |
294 |
34.6 |
0.4 |
0.104 |
1 |
0 |
0 |
0.000 |
| 55 |
58 |
|
[MAN]A:1627 |
4 |
1 |
294 |
f |
[MAN]A:1626 |
x,y,z |
1_555 |
2 |
1 |
295 |
29.4 |
1.6 |
0.306 |
0 |
0 |
0 |
0.000 |
| 56 |
59 |
|
[MAN]A:1628 |
4 |
1 |
294 |
f |
[BMA]A:1624 |
x,y,z |
1_555 |
4 |
1 |
291 |
28.9 |
0.9 |
0.184 |
0 |
0 |
0 |
0.000 |
| 57 |
60 |
|
[MAN]A:1919 |
5 |
1 |
296 |
f |
[MAN]A:1917 |
x,y,z |
1_555 |
3 |
1 |
292 |
27.7 |
1.2 |
0.228 |
0 |
0 |
0 |
0.000 |
| 58 |
61 |
|
[MAN]A:1918 |
5 |
1 |
291 |
f |
[BMA]A:1916 |
x,y,z |
1_555 |
3 |
1 |
296 |
24.4 |
0.2 |
0.096 |
0 |
0 |
0 |
0.000 |
| 59 |
62 |
|
[NAG]A:1622 |
2 |
1 |
365 |
f |
[NAG]A:1373 |
x,y,z |
1_555 |
1 |
1 |
362 |
23.2 |
1.0 |
0.429 |
0 |
0 |
0 |
0.000 |
| 60 |
63 |
|
[MAN]A:1625 |
3 |
1 |
295 |
f |
[NAG]A:1623 |
x,y,z |
1_555 |
3 |
1 |
365 |
22.2 |
0.9 |
0.255 |
0 |
0 |
0 |
0.000 |
| 61 |
64 |
|
A |
6 |
2 |
31847 |
◊ |
[NAG]A:1777 |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
365 |
20.6 |
0.1 |
0.339 |
0 |
0 |
0 |
0.000 |
| 62 |
65 |
|
[MAN]A:1629 |
4 |
1 |
292 |
f |
[MAN]A:1627 |
x,y,z |
1_555 |
3 |
1 |
294 |
20.4 |
1.0 |
0.241 |
0 |
0 |
0 |
0.000 |
| 63 |
66 |
|
A |
1 |
1 |
31847 |
f |
[DMS]A:3004 |
-x,y-1/2,-z-1/2 |
3_544 |
2 |
1 |
206 |
19.6 |
0.8 |
0.635 |
0 |
0 |
0 |
0.000 |
| 64 |
67 |
|
[MAN]A:1376 |
3 |
1 |
294 |
f |
[NAG]A:1374 |
x,y,z |
1_555 |
2 |
1 |
363 |
13.0 |
0.5 |
0.203 |
0 |
0 |
0 |
0.000 |
| 65 |
68 |
|
[MAN]A:1917 |
2 |
1 |
292 |
f |
[NAG]A:1915 |
x,y,z |
1_555 |
2 |
1 |
363 |
8.4 |
0.3 |
0.232 |
0 |
0 |
0 |
0.000 |
| 66 |
69 |
|
[MAN]A:1627 |
4 |
1 |
294 |
f |
[NAG]A:1623 |
x,y,z |
1_555 |
2 |
1 |
365 |
8.2 |
0.1 |
0.160 |
0 |
0 |
0 |
0.000 |
| 67 |
70 |
|
[MAN]A:1919 |
2 |
1 |
296 |
f |
[BMA]A:1916 |
x,y,z |
1_555 |
3 |
1 |
296 |
7.9 |
0.2 |
0.212 |
0 |
0 |
0 |
0.000 |
| 68 |
71 |
|
[MAN]A:1629 |
2 |
1 |
292 |
f |
[BMA]A:1624 |
x,y,z |
1_555 |
1 |
1 |
291 |
3.9 |
0.1 |
0.219 |
0 |
0 |
0 |
0.000 |
| 69 |
72 |
|
[MAN]A:1628 |
1 |
1 |
294 |
f |
[MAN]A:1626 |
x,y,z |
1_555 |
1 |
1 |
295 |
2.4 |
0.1 |
0.182 |
0 |
0 |
0 |
0.000 |
| 70 |
73 |
|
[MAN]A:1377 |
2 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
31847 |
1.5 |
0.1 |
0.368 |
0 |
0 |
0 |
0.000 |
|