## |
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 |
111 |
35 |
16628 |
◊ |
A |
x,y,z |
1_555 |
122 |
32 |
16446 |
1096.4 |
-17.1 |
0.166 |
10 |
6 |
0 |
1.000 |
2 |
2 |
|
B |
64 |
15 |
16628 |
x |
B |
x,y-1,z |
1_545 |
59 |
20 |
16628 |
540.7 |
-7.7 |
0.366 |
5 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
48 |
15 |
16446 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
53 |
17 |
16628 |
459.5 |
-4.3 |
0.539 |
1 |
3 |
0 |
0.000 |
4 |
4 |
|
B |
45 |
19 |
16628 |
◊ |
A |
x,y,z-1 |
1_554 |
40 |
10 |
16446 |
408.6 |
-6.8 |
0.269 |
5 |
1 |
0 |
0.000 |
5 |
5 |
|
A |
45 |
16 |
16446 |
◊ |
B |
x,y-1,z+1 |
1_546 |
42 |
14 |
16628 |
398.8 |
-4.1 |
0.472 |
3 |
0 |
0 |
0.000 |
6 |
6 |
|
A |
25 |
11 |
16446 |
◊ |
B |
x,y-1,z |
1_545 |
20 |
8 |
16628 |
215.1 |
-3.1 |
0.377 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
B |
13 |
5 |
16628 |
◊ |
A |
x,y-1,z |
1_545 |
17 |
6 |
16446 |
158.2 |
-1.5 |
0.463 |
2 |
0 |
0 |
0.000 |
8 |
8 |
|
[BGC]A:313 |
9 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
16446 |
144.4 |
0.8 |
0.300 |
1 |
0 |
0 |
0.000 |
9 |
9 |
|
[MAN]B:505 |
10 |
1 |
284 |
cf |
B |
x,y,z |
1_555 |
18 |
8 |
16628 |
142.1 |
2.1 |
0.400 |
2 |
0 |
0 |
0.000 |
10 |
10 |
|
[BGC]A:302 |
9 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
16446 |
122.5 |
1.8 |
0.358 |
1 |
0 |
0 |
0.000 |
11 |
11 |
|
[FUC]A:301 |
9 |
1 |
279 |
cf |
A |
x,y,z |
1_555 |
18 |
7 |
16446 |
120.8 |
2.8 |
0.411 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
[MAN]B:504 |
9 |
1 |
288 |
cf |
B |
x,y,z |
1_555 |
19 |
8 |
16628 |
120.3 |
2.3 |
0.448 |
2 |
0 |
0 |
0.000 |
13 |
13 |
|
[MAN]B:504 |
10 |
1 |
288 |
◊ |
A |
x,y,z-1 |
1_554 |
14 |
6 |
16446 |
119.7 |
1.8 |
0.336 |
1 |
0 |
0 |
0.000 |
14 |
14 |
|
A |
17 |
9 |
16446 |
◊ |
A |
-x,y,-z+1 |
2_556 |
17 |
9 |
16446 |
117.6 |
1.0 |
0.838 |
0 |
0 |
0 |
0.000 |
15 |
15 |
|
[MAN]A:310 |
10 |
1 |
290 |
cf |
A |
x,y,z |
1_555 |
13 |
4 |
16446 |
110.0 |
1.0 |
0.233 |
3 |
0 |
0 |
0.023 |
16 |
16 |
|
[MAN]A:307 |
10 |
1 |
288 |
cf |
A |
x,y,z |
1_555 |
14 |
6 |
16446 |
108.6 |
1.3 |
0.271 |
3 |
0 |
0 |
0.000 |
17 |
17 |
|
[FUC]B:501 |
10 |
1 |
282 |
cf |
B |
x,y,z |
1_555 |
15 |
7 |
16628 |
107.7 |
1.6 |
0.324 |
0 |
0 |
0 |
0.000 |
18 |
18 |
|
A |
9 |
2 |
16446 |
x |
A |
x,y,z-1 |
1_554 |
15 |
6 |
16446 |
106.0 |
-1.0 |
0.542 |
1 |
1 |
0 |
0.000 |
19 |
19 |
|
[MAN]B:509 |
8 |
1 |
288 |
cf |
B |
x,y,z |
1_555 |
12 |
6 |
16628 |
103.1 |
1.9 |
0.408 |
2 |
0 |
0 |
0.000 |
20 |
20 |
|
A |
19 |
5 |
16446 |
◊ |
[FUC]B:501 |
x,y-1,z+1 |
1_546 |
7 |
1 |
282 |
102.9 |
1.6 |
0.453 |
2 |
0 |
0 |
0.000 |
21 |
21 |
|
[MAN]B:510 |
10 |
1 |
288 |
cf |
B |
x,y,z |
1_555 |
10 |
4 |
16628 |
102.6 |
2.3 |
0.375 |
5 |
0 |
0 |
0.000 |
22 |
22 |
|
[MAN]A:303 |
10 |
1 |
283 |
cf |
A |
x,y,z |
1_555 |
12 |
5 |
16446 |
101.8 |
1.9 |
0.344 |
3 |
0 |
0 |
0.000 |
23 |
23 |
|
[BGC]B:502 |
8 |
1 |
294 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
16628 |
101.5 |
0.5 |
0.247 |
0 |
0 |
0 |
0.000 |
24 |
24 |
|
[FUC]A:305 |
8 |
1 |
280 |
cf |
A |
x,y,z |
1_555 |
15 |
6 |
16446 |
99.9 |
2.7 |
0.435 |
0 |
0 |
0 |
0.000 |
25 |
25 |
|
[MAN]B:503 |
9 |
1 |
287 |
cf |
B |
x,y,z |
1_555 |
12 |
5 |
16628 |
99.3 |
2.2 |
0.378 |
4 |
0 |
0 |
0.000 |
26 |
26 |
|
[MAN]B:511 |
8 |
1 |
291 |
cf |
B |
x,y,z |
1_555 |
12 |
6 |
16628 |
96.8 |
1.2 |
0.336 |
1 |
0 |
0 |
0.000 |
27 |
27 |
|
[MAN]B:512 |
8 |
1 |
292 |
cf |
B |
x,y,z |
1_555 |
15 |
6 |
16628 |
96.0 |
0.9 |
0.350 |
2 |
0 |
0 |
0.001 |
28 |
28 |
|
[FUC]A:312 |
8 |
1 |
280 |
cf |
A |
x,y,z |
1_555 |
10 |
4 |
16446 |
93.5 |
2.0 |
0.316 |
0 |
0 |
0 |
0.000 |
29 |
29 |
|
[MAN]A:311 |
9 |
1 |
282 |
cf |
A |
x,y,z |
1_555 |
11 |
5 |
16446 |
93.4 |
1.7 |
0.357 |
3 |
0 |
0 |
0.000 |
30 |
30 |
|
[MAN]A:309 |
8 |
1 |
288 |
cf |
A |
x,y,z |
1_555 |
11 |
5 |
16446 |
91.8 |
1.8 |
0.405 |
2 |
0 |
0 |
0.000 |
31 |
31 |
|
[SO4]A:315 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
16446 |
88.6 |
-13.4 |
0.730 |
2 |
0 |
0 |
0.910 |
32 |
32 |
|
[MAN]A:308 |
7 |
1 |
289 |
cf |
A |
x,y,z |
1_555 |
9 |
5 |
16446 |
88.5 |
1.9 |
0.462 |
3 |
0 |
0 |
0.000 |
33 |
33 |
|
[MAN]A:314 |
9 |
1 |
291 |
cf |
A |
x,y,z |
1_555 |
12 |
6 |
16446 |
87.6 |
1.2 |
0.313 |
1 |
0 |
0 |
0.000 |
34 |
34 |
|
[MAN]A:304 |
8 |
1 |
287 |
cf |
A |
x,y,z |
1_555 |
11 |
5 |
16446 |
86.2 |
1.5 |
0.359 |
3 |
0 |
0 |
0.000 |
35 |
35 |
|
[BGC]A:306 |
8 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
16446 |
84.4 |
0.5 |
0.228 |
0 |
0 |
0 |
0.000 |
36 |
36 |
|
[SO4]A:316 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
16446 |
79.1 |
-11.4 |
0.802 |
3 |
0 |
0 |
0.812 |
37 |
37 |
|
[MAN]A:307 |
6 |
1 |
288 |
◊ |
A |
-x,y,-z+1 |
2_556 |
11 |
4 |
16446 |
76.0 |
1.4 |
0.381 |
0 |
0 |
0 |
0.000 |
38 |
38 |
|
[NAG]B:508 |
10 |
1 |
346 |
cf |
[NAG]B:507 |
x,y,z |
1_555 |
5 |
1 |
354 |
74.2 |
1.5 |
0.093 |
1 |
0 |
0 |
0.000 |
39 |
39 |
|
[NAG]B:507 |
7 |
1 |
354 |
cf |
B |
x,y,z |
1_555 |
9 |
3 |
16628 |
73.4 |
2.3 |
0.477 |
0 |
0 |
0 |
0.000 |
40 |
40 |
|
[NAG]B:507 |
6 |
1 |
354 |
cf |
[FUC]B:506 |
x,y,z |
1_555 |
6 |
1 |
280 |
57.0 |
1.4 |
0.130 |
0 |
0 |
0 |
0.000 |
41 |
41 |
|
[BGC]A:306 |
4 |
1 |
295 |
cf |
[FUC]A:305 |
x,y,z |
1_555 |
5 |
1 |
280 |
56.6 |
1.8 |
0.280 |
0 |
0 |
0 |
0.000 |
42 |
42 |
|
[BGC]A:302 |
6 |
1 |
291 |
cf |
[FUC]A:301 |
x,y,z |
1_555 |
5 |
1 |
279 |
56.0 |
1.7 |
0.146 |
0 |
0 |
0 |
0.000 |
43 |
|
[BGC]A:313 |
5 |
1 |
294 |
cf |
[FUC]A:312 |
x,y,z |
1_555 |
5 |
1 |
280 |
55.4 |
1.7 |
0.173 |
0 |
0 |
0 |
0.000 |
Average: |
55.7 |
1.7 |
0.160 |
0 |
0 |
0 |
0.000 |
43 |
44 |
|
[MAN]A:308 |
6 |
1 |
289 |
◊ |
A |
-x,y,-z+1 |
2_556 |
9 |
4 |
16446 |
55.6 |
0.8 |
0.256 |
1 |
0 |
0 |
0.000 |
44 |
45 |
|
[BGC]B:502 |
6 |
1 |
294 |
cf |
[FUC]B:501 |
x,y,z |
1_555 |
5 |
1 |
282 |
55.5 |
1.6 |
0.170 |
1 |
0 |
0 |
0.000 |
45 |
46 |
|
[MAN]B:512 |
5 |
1 |
292 |
◊ |
[MAN]B:512 |
-x,y,-z |
2_555 |
5 |
1 |
292 |
49.6 |
1.8 |
0.262 |
0 |
0 |
0 |
0.000 |
46 |
47 |
|
[MAN]A:309 |
6 |
1 |
288 |
◊ |
[MAN]A:308 |
-x,y,-z+1 |
2_556 |
6 |
1 |
289 |
49.4 |
0.5 |
0.089 |
0 |
0 |
0 |
0.000 |
47 |
48 |
|
[NAG]B:508 |
7 |
1 |
346 |
f |
[FUC]B:506 |
x,y,z |
1_555 |
3 |
1 |
280 |
43.3 |
1.7 |
0.169 |
0 |
0 |
0 |
0.000 |
48 |
49 |
|
A |
5 |
2 |
16446 |
◊ |
[MAN]A:314 |
x,y,z-1 |
1_554 |
4 |
1 |
291 |
40.9 |
0.3 |
0.332 |
0 |
0 |
0 |
0.000 |
49 |
50 |
|
[FUC]B:506 |
4 |
1 |
280 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
16628 |
37.9 |
0.9 |
0.451 |
0 |
0 |
0 |
0.000 |
50 |
51 |
|
[BGC]A:302 |
4 |
1 |
291 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
3 |
1 |
16628 |
37.7 |
0.3 |
0.294 |
2 |
0 |
0 |
0.000 |
51 |
52 |
|
[FUC]B:506 |
5 |
1 |
280 |
◊ |
A |
x,y,z-1 |
1_554 |
3 |
1 |
16446 |
37.0 |
0.3 |
0.161 |
0 |
0 |
0 |
0.000 |
52 |
53 |
|
[MAN]A:308 |
3 |
1 |
289 |
◊ |
[MAN]A:308 |
-x,y,-z+1 |
2_556 |
3 |
1 |
289 |
33.9 |
1.3 |
0.317 |
1 |
0 |
0 |
0.000 |
53 |
54 |
|
[BGC]B:502 |
4 |
1 |
294 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
16446 |
33.8 |
0.3 |
0.286 |
1 |
0 |
0 |
0.011 |
54 |
55 |
|
[FUC]A:301 |
4 |
1 |
279 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
5 |
1 |
16628 |
32.3 |
0.6 |
0.288 |
1 |
0 |
0 |
0.000 |
55 |
56 |
|
A |
7 |
3 |
16446 |
◊ |
A |
-x,y,-z |
2_555 |
7 |
3 |
16446 |
25.4 |
-0.3 |
0.612 |
0 |
0 |
0 |
0.000 |
56 |
57 |
|
[MAN]B:509 |
3 |
1 |
288 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
16446 |
24.1 |
0.3 |
0.407 |
0 |
0 |
0 |
0.000 |
57 |
58 |
|
[MAN]A:308 |
3 |
1 |
289 |
f |
[MAN]A:307 |
x,y,z |
1_555 |
2 |
1 |
288 |
15.0 |
0.4 |
0.256 |
0 |
0 |
0 |
0.000 |
58 |
59 |
|
A |
4 |
2 |
16446 |
◊ |
[BGC]B:502 |
x,y-1,z+1 |
1_546 |
5 |
1 |
294 |
11.0 |
-0.0 |
0.264 |
0 |
0 |
0 |
0.000 |
59 |
60 |
|
B |
1 |
1 |
16628 |
◊ |
[SO4]A:316 |
x,y,z-1 |
1_554 |
1 |
1 |
185 |
7.9 |
-0.9 |
0.797 |
0 |
0 |
0 |
0.000 |
60 |
61 |
|
[MAN]A:309 |
2 |
1 |
288 |
f |
[MAN]A:308 |
x,y,z |
1_555 |
1 |
1 |
289 |
6.2 |
0.0 |
0.219 |
0 |
0 |
0 |
0.000 |
61 |
62 |
|
A |
1 |
1 |
16446 |
◊ |
B |
-x,y-2,-z+1 |
2_536 |
1 |
1 |
16628 |
4.7 |
-0.1 |
0.396 |
0 |
0 |
0 |
0.000 |
62 |
63 |
|
[BGC]A:306 |
1 |
1 |
295 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
16628 |
3.4 |
-0.0 |
0.282 |
0 |
0 |
0 |
0.001 |
63 |
64 |
|
A |
1 |
1 |
16446 |
◊ |
B |
-x,y-1,-z+1 |
2_546 |
1 |
1 |
16628 |
0.3 |
-0.0 |
0.595 |
0 |
0 |
0 |
0.000 |
|