## |
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 |
121 |
37 |
12352 |
◊ |
A |
x,y,z |
1_555 |
124 |
34 |
12672 |
1162.3 |
-16.8 |
0.061 |
9 |
6 |
1 |
0.000 |
2 |
2 |
|
C |
65 |
16 |
9016 |
◊ |
A |
x,y,z |
1_555 |
64 |
19 |
12672 |
552.5 |
-2.2 |
0.506 |
8 |
3 |
0 |
0.000 |
3 |
3 |
|
B |
50 |
11 |
12352 |
x |
B |
-y,-x+1,-z+1/2 |
8_565 |
45 |
14 |
12352 |
431.4 |
1.1 |
0.762 |
5 |
4 |
0 |
0.000 |
4 |
4 |
|
C |
41 |
14 |
9016 |
◊ |
B |
x,y,z |
1_555 |
36 |
12 |
12352 |
371.8 |
-5.1 |
0.198 |
2 |
0 |
0 |
0.000 |
5 |
5 |
|
A |
44 |
12 |
12672 |
◊ |
C |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
40 |
12 |
9016 |
360.0 |
-2.0 |
0.498 |
3 |
0 |
0 |
0.000 |
6 |
6 |
|
B |
25 |
10 |
12352 |
◊ |
B |
-y,-x,-z+1/2 |
8_555 |
25 |
10 |
12352 |
201.3 |
-0.1 |
0.635 |
2 |
4 |
0 |
0.000 |
7 |
7 |
|
A |
15 |
3 |
12672 |
x |
A |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
23 |
8 |
12672 |
185.3 |
0.8 |
0.705 |
1 |
0 |
0 |
0.000 |
8 |
8 |
|
[NAG]B:1001 |
13 |
1 |
360 |
cf |
B |
x,y,z |
1_555 |
20 |
8 |
12352 |
165.8 |
4.3 |
0.394 |
1 |
0 |
0 |
0.000 |
9 |
|
[NAG]A:1001 |
13 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
16 |
6 |
12672 |
130.1 |
3.0 |
0.320 |
1 |
0 |
0 |
0.000 |
Average: |
148.0 |
3.7 |
0.357 |
1 |
0 |
0 |
0.000 |
9 |
10 |
|
[NAG]C:1101 |
12 |
1 |
362 |
cf |
C |
x,y,z |
1_555 |
23 |
7 |
9016 |
147.8 |
3.7 |
0.405 |
1 |
0 |
0 |
0.000 |
10 |
11 |
|
[NAG]C:1001 |
12 |
1 |
352 |
cf |
C |
x,y,z |
1_555 |
18 |
7 |
9016 |
140.3 |
4.1 |
0.486 |
0 |
0 |
0 |
0.000 |
11 |
12 |
|
[GAL]A:1009 |
10 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
12672 |
140.0 |
3.2 |
0.324 |
3 |
0 |
0 |
0.000 |
12 |
13 |
|
[GAL]B:1009 |
10 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
12352 |
134.1 |
2.4 |
0.308 |
1 |
0 |
0 |
0.000 |
13 |
14 |
|
[NAG]A:1008 |
10 |
1 |
355 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
12672 |
124.5 |
2.6 |
0.318 |
2 |
0 |
0 |
0.000 |
15 |
|
[NAG]B:1008 |
9 |
1 |
360 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
12352 |
100.4 |
1.5 |
0.292 |
0 |
0 |
0 |
0.000 |
Average: |
112.5 |
2.0 |
0.305 |
1 |
0 |
0 |
0.000 |
14 |
16 |
|
[NAG]B:1002 |
11 |
1 |
358 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
12352 |
116.2 |
1.9 |
0.240 |
1 |
0 |
0 |
0.000 |
17 |
|
[NAG]A:1002 |
11 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
12672 |
114.1 |
1.7 |
0.228 |
1 |
0 |
0 |
0.000 |
Average: |
115.2 |
1.8 |
0.234 |
1 |
0 |
0 |
0.000 |
15 |
18 |
|
A |
9 |
5 |
12672 |
◊ |
C |
x-1,y+1,z |
1_465 |
7 |
2 |
9016 |
92.6 |
0.0 |
0.628 |
3 |
0 |
0 |
0.000 |
16 |
19 |
|
[NAG]C:1102 |
10 |
1 |
361 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
9016 |
87.0 |
0.7 |
0.187 |
1 |
0 |
0 |
0.000 |
17 |
20 |
|
[NAG]B:1002 |
10 |
1 |
358 |
cf |
[NAG]B:1001 |
x,y,z |
1_555 |
6 |
1 |
360 |
76.0 |
2.1 |
0.090 |
1 |
0 |
0 |
0.000 |
21 |
|
[NAG]A:1002 |
9 |
1 |
360 |
cf |
[NAG]A:1001 |
x,y,z |
1_555 |
6 |
1 |
361 |
68.6 |
2.1 |
0.121 |
1 |
0 |
0 |
0.000 |
Average: |
72.3 |
2.1 |
0.105 |
1 |
0 |
0 |
0.000 |
18 |
22 |
|
[NAG]C:1102 |
9 |
1 |
361 |
cf |
[NAG]C:1101 |
x,y,z |
1_555 |
7 |
1 |
362 |
74.1 |
1.8 |
0.094 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[MAN]A:1007 |
8 |
1 |
288 |
cf |
[NAG]A:1008 |
x,y,z |
1_555 |
8 |
1 |
355 |
72.9 |
2.8 |
0.134 |
0 |
0 |
0 |
0.000 |
24 |
|
[MAN]A:1004 |
7 |
1 |
289 |
cf |
[NAG]A:1005 |
x,y,z |
1_555 |
8 |
1 |
345 |
67.7 |
2.4 |
0.148 |
0 |
0 |
0 |
0.000 |
Average: |
70.3 |
2.6 |
0.141 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
[MAN]B:1004 |
7 |
1 |
291 |
cf |
[NAG]B:1005 |
x,y,z |
1_555 |
8 |
1 |
360 |
71.6 |
2.7 |
0.182 |
0 |
0 |
0 |
0.000 |
26 |
|
[MAN]B:1007 |
8 |
1 |
290 |
cf |
[NAG]B:1008 |
x,y,z |
1_555 |
6 |
1 |
360 |
71.3 |
2.5 |
0.160 |
0 |
0 |
0 |
0.000 |
Average: |
71.5 |
2.6 |
0.171 |
0 |
0 |
0 |
0.000 |
21 |
27 |
|
[MAN]C:1004 |
9 |
1 |
289 |
cf |
[NAG]C:1005 |
x,y,z |
1_555 |
8 |
1 |
361 |
70.8 |
2.1 |
0.085 |
1 |
0 |
0 |
0.000 |
22 |
28 |
|
[BMA]B:1003 |
7 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
8 |
2 |
12352 |
68.3 |
1.1 |
0.174 |
0 |
0 |
0 |
0.000 |
29 |
|
[BMA]A:1003 |
7 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
12672 |
64.8 |
1.0 |
0.186 |
0 |
0 |
0 |
0.000 |
Average: |
66.6 |
1.0 |
0.180 |
0 |
0 |
0 |
0.000 |
23 |
30 |
|
[NAG]C:1002 |
9 |
1 |
362 |
cf |
[NAG]C:1001 |
x,y,z |
1_555 |
6 |
1 |
352 |
66.0 |
1.7 |
0.100 |
0 |
0 |
0 |
0.000 |
24 |
31 |
|
[MAN]C:1007 |
7 |
1 |
292 |
cf |
[NAG]C:1008 |
x,y,z |
1_555 |
9 |
1 |
354 |
62.5 |
1.9 |
0.090 |
0 |
0 |
0 |
0.000 |
25 |
32 |
|
[GAL]B:1009 |
7 |
1 |
290 |
cf |
[NAG]B:1008 |
x,y,z |
1_555 |
5 |
1 |
360 |
62.1 |
1.3 |
0.112 |
0 |
0 |
0 |
0.000 |
26 |
33 |
|
[BMA]B:1003 |
6 |
1 |
290 |
cf |
[NAG]B:1002 |
x,y,z |
1_555 |
5 |
1 |
358 |
61.5 |
1.4 |
0.129 |
1 |
0 |
0 |
0.000 |
34 |
|
[BMA]A:1003 |
6 |
1 |
291 |
cf |
[NAG]A:1002 |
x,y,z |
1_555 |
5 |
1 |
360 |
58.2 |
1.2 |
0.129 |
1 |
0 |
0 |
0.000 |
Average: |
59.9 |
1.3 |
0.129 |
1 |
0 |
0 |
0.000 |
27 |
35 |
|
[BMA]C:1103 |
6 |
1 |
294 |
cf |
[NAG]C:1102 |
x,y,z |
1_555 |
6 |
1 |
361 |
61.1 |
1.6 |
0.137 |
0 |
0 |
0 |
0.000 |
28 |
36 |
|
[MAN]B:1004 |
6 |
1 |
291 |
cf |
[BMA]B:1003 |
x,y,z |
1_555 |
5 |
1 |
290 |
59.7 |
2.6 |
0.262 |
0 |
0 |
0 |
0.000 |
37 |
|
[MAN]A:1004 |
7 |
1 |
289 |
cf |
[BMA]A:1003 |
x,y,z |
1_555 |
6 |
1 |
291 |
57.6 |
2.6 |
0.209 |
0 |
0 |
0 |
0.000 |
Average: |
58.6 |
2.6 |
0.235 |
0 |
0 |
0 |
0.000 |
29 |
38 |
|
[BMA]C:1003 |
7 |
1 |
290 |
cf |
[NAG]C:1002 |
x,y,z |
1_555 |
5 |
1 |
362 |
58.5 |
1.1 |
0.104 |
0 |
0 |
0 |
0.000 |
30 |
39 |
|
[MAN]C:1004 |
7 |
1 |
289 |
cf |
[BMA]C:1003 |
x,y,z |
1_555 |
6 |
1 |
290 |
57.6 |
2.5 |
0.179 |
0 |
0 |
0 |
0.000 |
31 |
40 |
|
[GAL]A:1009 |
7 |
1 |
291 |
cf |
[NAG]A:1008 |
x,y,z |
1_555 |
5 |
1 |
355 |
57.4 |
0.9 |
0.095 |
0 |
0 |
0 |
0.000 |
32 |
41 |
|
[NAG]A:1001 |
3 |
1 |
361 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
9016 |
55.5 |
1.7 |
0.710 |
0 |
0 |
0 |
0.000 |
33 |
42 |
|
[MAN]C:1007 |
6 |
1 |
292 |
◊ |
A |
x,y,z |
1_555 |
8 |
1 |
12672 |
54.6 |
0.0 |
0.213 |
0 |
0 |
0 |
0.000 |
34 |
43 |
|
[MAN]B:1007 |
6 |
1 |
290 |
f |
[NAG]B:1002 |
x,y,z |
1_555 |
6 |
1 |
358 |
53.4 |
2.0 |
0.175 |
0 |
0 |
0 |
0.000 |
44 |
|
[MAN]A:1007 |
6 |
1 |
288 |
f |
[NAG]A:1002 |
x,y,z |
1_555 |
6 |
1 |
360 |
48.7 |
1.9 |
0.168 |
0 |
0 |
0 |
0.000 |
Average: |
51.1 |
1.9 |
0.172 |
0 |
0 |
0 |
0.000 |
35 |
45 |
|
[NAG]C:1001 |
6 |
1 |
352 |
◊ |
[NAG]A:1001 |
x,y,z |
1_555 |
8 |
1 |
361 |
52.3 |
2.3 |
0.165 |
0 |
0 |
0 |
0.000 |
36 |
46 |
|
[MAN]B:1007 |
5 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
12352 |
51.2 |
1.4 |
0.424 |
0 |
0 |
0 |
0.000 |
47 |
|
[MAN]A:1007 |
4 |
1 |
288 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
12672 |
47.0 |
1.1 |
0.355 |
0 |
0 |
0 |
0.000 |
Average: |
49.1 |
1.3 |
0.389 |
0 |
0 |
0 |
0.000 |
37 |
48 |
|
[FUC]C:1011 |
5 |
1 |
277 |
cf |
[NAG]C:1001 |
x,y,z |
1_555 |
5 |
1 |
352 |
51.2 |
2.0 |
0.287 |
0 |
0 |
0 |
0.000 |
38 |
49 |
|
[MAN]C:1007 |
6 |
1 |
292 |
cf |
[BMA]C:1003 |
x,y,z |
1_555 |
5 |
1 |
290 |
50.9 |
2.3 |
0.242 |
0 |
0 |
0 |
0.000 |
39 |
50 |
|
[MAN]A:1007 |
6 |
1 |
288 |
cf |
[BMA]A:1003 |
x,y,z |
1_555 |
3 |
1 |
291 |
50.6 |
2.2 |
0.295 |
0 |
0 |
0 |
0.000 |
51 |
|
[MAN]B:1007 |
6 |
1 |
290 |
cf |
[BMA]B:1003 |
x,y,z |
1_555 |
3 |
1 |
290 |
50.5 |
2.3 |
0.282 |
0 |
0 |
0 |
0.000 |
Average: |
50.5 |
2.2 |
0.289 |
0 |
0 |
0 |
0.000 |
40 |
52 |
|
[NAG]C:1002 |
6 |
1 |
362 |
f |
C |
x,y,z |
1_555 |
6 |
4 |
9016 |
49.3 |
1.7 |
0.444 |
1 |
0 |
0 |
0.000 |
41 |
53 |
|
[FUC]C:1011 |
4 |
1 |
277 |
f |
[NAG]C:1002 |
x,y,z |
1_555 |
5 |
1 |
362 |
44.2 |
2.1 |
0.286 |
0 |
0 |
0 |
0.000 |
42 |
54 |
|
[NAG]C:1008 |
5 |
1 |
354 |
f |
[NAG]C:1002 |
x,y,z |
1_555 |
5 |
1 |
362 |
40.1 |
1.5 |
0.214 |
0 |
0 |
0 |
0.000 |
43 |
55 |
|
[NAG]A:1005 |
3 |
1 |
345 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
12672 |
39.2 |
1.3 |
0.523 |
1 |
0 |
0 |
0.000 |
44 |
56 |
|
[BMA]C:1003 |
4 |
1 |
290 |
◊ |
A |
x,y,z |
1_555 |
7 |
1 |
12672 |
39.0 |
0.7 |
0.344 |
0 |
0 |
0 |
0.000 |
45 |
57 |
|
[NAG]C:1008 |
3 |
1 |
354 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
9016 |
36.9 |
1.0 |
0.478 |
0 |
0 |
0 |
0.000 |
46 |
58 |
|
[NAG]C:1002 |
4 |
1 |
362 |
◊ |
[NAG]A:1001 |
x,y,z |
1_555 |
7 |
1 |
361 |
36.8 |
1.0 |
0.130 |
2 |
0 |
0 |
0.000 |
47 |
59 |
|
[NAG]B:1005 |
2 |
1 |
360 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
12352 |
34.5 |
1.7 |
0.746 |
0 |
0 |
0 |
0.000 |
48 |
60 |
|
[MAN]B:1004 |
5 |
1 |
291 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
12352 |
33.0 |
-0.2 |
0.125 |
0 |
0 |
0 |
0.000 |
49 |
61 |
|
[MAN]A:1004 |
5 |
1 |
289 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
12672 |
31.2 |
-0.2 |
0.130 |
0 |
0 |
0 |
0.000 |
50 |
62 |
|
[BMA]A:1003 |
3 |
1 |
291 |
f |
[NAG]A:1005 |
x,y,z |
1_555 |
4 |
1 |
345 |
27.4 |
1.2 |
0.236 |
0 |
0 |
0 |
0.000 |
51 |
63 |
|
[NAG]C:1008 |
4 |
1 |
354 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12672 |
26.9 |
0.7 |
0.388 |
0 |
0 |
0 |
0.000 |
52 |
64 |
|
[MAN]A:1004 |
3 |
1 |
289 |
f |
[NAG]A:1002 |
x,y,z |
1_555 |
2 |
1 |
360 |
21.5 |
0.7 |
0.263 |
0 |
0 |
0 |
0.000 |
65 |
|
[MAN]B:1004 |
3 |
1 |
291 |
f |
[NAG]B:1002 |
x,y,z |
1_555 |
2 |
1 |
358 |
17.3 |
0.6 |
0.231 |
0 |
0 |
0 |
0.000 |
Average: |
19.4 |
0.7 |
0.247 |
0 |
0 |
0 |
0.000 |
53 |
66 |
|
[MAN]C:1004 |
2 |
1 |
289 |
◊ |
[MAN]A:1007 |
x,y,z |
1_555 |
2 |
1 |
288 |
21.5 |
0.1 |
0.209 |
1 |
0 |
0 |
0.000 |
54 |
67 |
|
[NAG]C:1005 |
1 |
1 |
361 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
12672 |
21.3 |
1.1 |
0.801 |
0 |
0 |
0 |
0.000 |
55 |
68 |
|
[BMA]B:1003 |
3 |
1 |
290 |
f |
[NAG]B:1005 |
x,y,z |
1_555 |
4 |
1 |
360 |
20.5 |
0.8 |
0.190 |
0 |
0 |
0 |
0.000 |
56 |
69 |
|
[NAG]C:1005 |
1 |
1 |
361 |
◊ |
[NAG]A:1002 |
x,y,z |
1_555 |
1 |
1 |
360 |
19.1 |
1.3 |
0.786 |
0 |
0 |
0 |
0.000 |
57 |
70 |
|
[BMA]A:1003 |
2 |
1 |
291 |
f |
[NAG]A:1008 |
x,y,z |
1_555 |
3 |
1 |
355 |
18.6 |
0.9 |
0.254 |
0 |
0 |
0 |
0.000 |
71 |
|
[BMA]B:1003 |
2 |
1 |
290 |
f |
[NAG]B:1008 |
x,y,z |
1_555 |
4 |
1 |
360 |
18.1 |
0.9 |
0.248 |
0 |
0 |
0 |
0.000 |
Average: |
18.4 |
0.9 |
0.251 |
0 |
0 |
0 |
0.000 |
58 |
72 |
|
[BMA]C:1003 |
3 |
1 |
290 |
f |
[NAG]C:1008 |
x,y,z |
1_555 |
3 |
1 |
354 |
17.8 |
0.2 |
0.205 |
0 |
0 |
0 |
0.000 |
59 |
73 |
|
[MAN]A:1007 |
3 |
1 |
288 |
◊ |
[NAG]C:1005 |
x,y,z |
1_555 |
2 |
1 |
361 |
17.0 |
0.6 |
0.242 |
0 |
0 |
0 |
0.000 |
60 |
74 |
|
[BMA]C:1003 |
3 |
1 |
290 |
f |
[NAG]C:1005 |
x,y,z |
1_555 |
2 |
1 |
361 |
16.3 |
0.5 |
0.262 |
0 |
0 |
0 |
0.000 |
61 |
75 |
|
[NAG]C:1001 |
2 |
1 |
352 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
12672 |
15.8 |
0.5 |
0.478 |
0 |
0 |
0 |
0.000 |
62 |
76 |
|
[FUC]C:1011 |
4 |
1 |
277 |
◊ |
[NAG]B:1005 |
x,y,z |
1_555 |
3 |
1 |
360 |
15.7 |
0.5 |
0.176 |
0 |
0 |
0 |
0.000 |
63 |
77 |
|
[NAG]C:1002 |
2 |
1 |
362 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12672 |
12.9 |
0.2 |
0.414 |
0 |
0 |
0 |
0.000 |
64 |
78 |
|
[MAN]C:1007 |
2 |
1 |
292 |
f |
[NAG]C:1002 |
x,y,z |
1_555 |
1 |
1 |
362 |
11.2 |
0.5 |
0.275 |
0 |
0 |
0 |
0.000 |
65 |
79 |
|
[NAG]C:1002 |
2 |
1 |
362 |
◊ |
[NAG]A:1002 |
x,y,z |
1_555 |
2 |
1 |
360 |
11.1 |
0.7 |
0.230 |
0 |
0 |
0 |
0.000 |
66 |
80 |
|
[BMA]C:1103 |
2 |
1 |
294 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
9016 |
11.0 |
0.2 |
0.246 |
0 |
0 |
0 |
0.000 |
67 |
81 |
|
[BMA]C:1003 |
4 |
1 |
290 |
◊ |
[NAG]A:1001 |
x,y,z |
1_555 |
1 |
1 |
361 |
8.6 |
0.4 |
0.191 |
0 |
0 |
0 |
0.000 |
68 |
82 |
|
B |
2 |
1 |
12352 |
◊ |
C |
x-1,y+1,z |
1_465 |
2 |
2 |
9016 |
7.5 |
0.4 |
0.797 |
0 |
0 |
0 |
0.000 |
69 |
83 |
|
[FUC]C:1011 |
2 |
1 |
277 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
9016 |
3.8 |
0.2 |
0.456 |
0 |
0 |
0 |
0.000 |
70 |
84 |
|
[MAN]C:1004 |
1 |
1 |
289 |
f |
[NAG]C:1002 |
x,y,z |
1_555 |
1 |
1 |
362 |
2.8 |
0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
71 |
85 |
|
[MAN]C:1004 |
2 |
1 |
289 |
◊ |
[NAG]A:1002 |
x,y,z |
1_555 |
1 |
1 |
360 |
1.9 |
0.1 |
0.182 |
0 |
0 |
0 |
0.000 |
72 |
86 |
|
[NAG]C:1001 |
1 |
1 |
352 |
◊ |
[NAG]A:1002 |
x,y,z |
1_555 |
1 |
1 |
360 |
0.8 |
0.0 |
0.143 |
0 |
0 |
0 |
0.000 |
73 |
87 |
|
[MAN]C:1007 |
1 |
1 |
292 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
9016 |
0.7 |
0.0 |
0.350 |
0 |
0 |
0 |
0.000 |
|