## |
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 |
392 |
113 |
25006 |
x |
B |
-y,x-y+1,z |
2_565 |
371 |
104 |
25006 |
3610.6 |
-19.5 |
0.395 |
50 |
18 |
0 |
0.351 |
2 |
|
A |
388 |
112 |
24845 |
x |
A |
-y+1,x-y+1,z |
2_665 |
371 |
104 |
24845 |
3586.7 |
-19.5 |
0.395 |
49 |
17 |
0 |
0.351 |
Average: |
3598.6 |
-19.5 |
0.395 |
50 |
18 |
0 |
0.351 |
2 |
3 |
|
B |
57 |
18 |
25006 |
◊ |
A |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
50 |
16 |
24845 |
450.6 |
-4.8 |
0.297 |
4 |
0 |
0 |
0.000 |
3 |
4 |
|
[BGC]B:916 |
12 |
1 |
306 |
◊ |
B |
x,y,z |
1_555 |
24 |
11 |
25006 |
176.3 |
2.0 |
0.337 |
1 |
0 |
0 |
0.000 |
5 |
|
[BGC]A:911 |
12 |
1 |
305 |
◊ |
A |
x,y,z |
1_555 |
24 |
10 |
24845 |
173.3 |
1.8 |
0.343 |
1 |
0 |
0 |
0.000 |
Average: |
174.8 |
1.9 |
0.340 |
1 |
0 |
0 |
0.000 |
4 |
6 |
|
B |
18 |
9 |
25006 |
◊ |
A |
x,y,z |
1_555 |
19 |
8 |
24845 |
169.4 |
-1.8 |
0.330 |
2 |
0 |
0 |
0.000 |
5 |
7 |
|
[FUC]B:915 |
9 |
1 |
283 |
◊ |
B |
x,y,z |
1_555 |
22 |
10 |
25006 |
138.4 |
3.7 |
0.539 |
1 |
0 |
0 |
0.000 |
8 |
|
[FUC]A:910 |
9 |
1 |
281 |
◊ |
A |
x,y,z |
1_555 |
23 |
10 |
24845 |
135.2 |
3.5 |
0.540 |
1 |
0 |
0 |
0.000 |
Average: |
136.8 |
3.6 |
0.540 |
1 |
0 |
0 |
0.000 |
6 |
9 |
|
[PG4]B:910 |
10 |
1 |
395 |
f |
B |
x,y,z |
1_555 |
23 |
8 |
25006 |
138.2 |
4.5 |
0.457 |
0 |
0 |
0 |
0.000 |
7 |
10 |
|
B |
13 |
5 |
25006 |
◊ |
[PG4]B:910 |
-y,x-y+1,z |
2_565 |
10 |
1 |
395 |
111.4 |
2.8 |
0.340 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
[FUC]B:914 |
9 |
1 |
280 |
◊ |
B |
x,y,z |
1_555 |
12 |
7 |
25006 |
107.5 |
1.9 |
0.281 |
2 |
0 |
0 |
0.000 |
12 |
|
[FUC]A:909 |
9 |
1 |
281 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
24845 |
98.9 |
1.7 |
0.323 |
2 |
0 |
0 |
0.000 |
Average: |
103.2 |
1.8 |
0.302 |
2 |
0 |
0 |
0.000 |
9 |
13 |
|
[SO4]A:904 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
24845 |
105.0 |
-16.9 |
0.677 |
5 |
0 |
0 |
0.153 |
10 |
14 |
|
[SO4]B:903 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
25006 |
104.5 |
-16.7 |
0.678 |
4 |
0 |
0 |
0.129 |
11 |
15 |
|
[HLA]B:911 |
7 |
1 |
363 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
25006 |
92.7 |
2.0 |
0.524 |
3 |
0 |
0 |
0.000 |
12 |
16 |
|
[SO4]B:902 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
25006 |
89.6 |
-13.2 |
0.891 |
5 |
0 |
0 |
0.107 |
13 |
17 |
|
[SO4]A:902 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
24845 |
89.3 |
-13.3 |
0.885 |
5 |
0 |
0 |
0.124 |
14 |
18 |
|
[SO4]B:901 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
25006 |
85.1 |
-10.9 |
0.886 |
3 |
0 |
0 |
0.085 |
15 |
19 |
|
[SO4]A:903 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
24845 |
84.8 |
-12.6 |
0.699 |
4 |
0 |
0 |
0.115 |
16 |
20 |
|
[HLA]A:906 |
6 |
1 |
362 |
◊ |
A |
x,y,z |
1_555 |
8 |
5 |
24845 |
83.5 |
1.4 |
0.551 |
2 |
0 |
0 |
0.000 |
17 |
21 |
|
[SO4]A:901 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
24845 |
83.0 |
-10.5 |
0.917 |
3 |
0 |
0 |
0.095 |
18 |
22 |
|
[SO4]B:904 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
25006 |
78.4 |
-11.4 |
0.744 |
3 |
0 |
0 |
0.089 |
19 |
23 |
|
[EDO]B:909 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
25006 |
75.6 |
2.5 |
0.299 |
1 |
0 |
0 |
0.000 |
20 |
24 |
|
[BDP]B:912 |
7 |
1 |
305 |
cf |
[HLA]B:911 |
x,y,z |
1_555 |
8 |
1 |
363 |
70.4 |
1.6 |
0.256 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
[FUC]B:914 |
6 |
1 |
280 |
cf |
[GLA]B:913 |
x,y,z |
1_555 |
7 |
1 |
291 |
66.1 |
2.4 |
0.165 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[SO4]A:903 |
4 |
1 |
186 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
9 |
5 |
24845 |
65.4 |
-9.0 |
0.574 |
0 |
0 |
0 |
0.072 |
23 |
27 |
|
[BDP]A:907 |
7 |
1 |
302 |
cf |
[HLA]A:906 |
x,y,z |
1_555 |
7 |
1 |
362 |
64.4 |
1.4 |
0.288 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
[FUC]B:915 |
6 |
1 |
283 |
cf |
[FUC]B:914 |
x,y,z |
1_555 |
6 |
1 |
280 |
62.8 |
1.9 |
0.112 |
0 |
0 |
0 |
0.000 |
29 |
|
[FUC]A:910 |
5 |
1 |
281 |
cf |
[FUC]A:909 |
x,y,z |
1_555 |
6 |
1 |
281 |
59.6 |
1.8 |
0.202 |
0 |
0 |
0 |
0.000 |
Average: |
61.2 |
1.8 |
0.157 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
[SO4]B:905 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
25006 |
61.5 |
-7.9 |
0.842 |
4 |
0 |
0 |
0.067 |
26 |
31 |
|
[FUC]A:909 |
6 |
1 |
281 |
cf |
[GLA]A:908 |
x,y,z |
1_555 |
6 |
1 |
294 |
59.8 |
2.3 |
0.195 |
0 |
0 |
0 |
0.000 |
27 |
32 |
|
[BDP]A:907 |
7 |
1 |
302 |
◊ |
A |
x,y,z |
1_555 |
6 |
4 |
24845 |
59.4 |
1.6 |
0.600 |
1 |
0 |
0 |
0.000 |
33 |
|
[BDP]B:912 |
8 |
1 |
305 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
25006 |
58.4 |
1.5 |
0.475 |
1 |
0 |
0 |
0.000 |
Average: |
58.9 |
1.6 |
0.537 |
1 |
0 |
0 |
0.000 |
28 |
34 |
|
[BGC]B:916 |
5 |
1 |
306 |
cf |
[FUC]B:915 |
x,y,z |
1_555 |
6 |
1 |
283 |
58.4 |
1.9 |
0.210 |
0 |
0 |
0 |
0.000 |
35 |
|
[BGC]A:911 |
6 |
1 |
305 |
cf |
[FUC]A:910 |
x,y,z |
1_555 |
6 |
1 |
281 |
58.1 |
1.8 |
0.209 |
0 |
0 |
0 |
0.000 |
Average: |
58.2 |
1.9 |
0.210 |
0 |
0 |
0 |
0.000 |
29 |
36 |
|
[GLA]A:908 |
5 |
1 |
294 |
cf |
[BDP]A:907 |
x,y,z |
1_555 |
4 |
1 |
302 |
54.4 |
2.1 |
0.340 |
0 |
0 |
0 |
0.000 |
30 |
37 |
|
B |
8 |
5 |
25006 |
◊ |
[SO4]B:906 |
-y,x-y+1,z |
2_565 |
4 |
1 |
185 |
54.1 |
-6.3 |
0.944 |
3 |
0 |
0 |
0.053 |
31 |
38 |
|
[SO4]B:906 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
25006 |
54.0 |
-6.3 |
0.944 |
3 |
0 |
0 |
0.053 |
32 |
39 |
|
[SO4]B:906 |
4 |
1 |
185 |
◊ |
B |
-y,x-y+1,z |
2_565 |
8 |
5 |
25006 |
53.9 |
-6.2 |
0.944 |
3 |
0 |
0 |
0.053 |
33 |
40 |
|
[GLA]B:913 |
5 |
1 |
291 |
cf |
[BDP]B:912 |
x,y,z |
1_555 |
4 |
1 |
305 |
53.3 |
1.9 |
0.322 |
0 |
0 |
0 |
0.000 |
34 |
41 |
|
[GLA]A:908 |
4 |
1 |
294 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
25006 |
48.5 |
1.6 |
0.547 |
1 |
0 |
0 |
0.000 |
35 |
42 |
|
[MG]B:907 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
25006 |
47.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.046 |
43 |
|
A |
14 |
6 |
24845 |
f |
[MG]A:905 |
-y+1,x-y+1,z |
2_665 |
1 |
1 |
98 |
47.0 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.046 |
Average: |
47.2 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.046 |
36 |
44 |
|
[FUC]A:909 |
3 |
1 |
281 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
25006 |
44.6 |
0.8 |
0.475 |
0 |
0 |
0 |
0.000 |
37 |
45 |
|
[MG]B:907 |
1 |
1 |
98 |
◊ |
B |
-y,x-y+1,z |
2_565 |
9 |
3 |
25006 |
36.0 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.029 |
46 |
|
[MG]A:905 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
24845 |
35.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
35.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.029 |
38 |
47 |
|
[SO4]B:905 |
4 |
1 |
184 |
◊ |
[PG4]B:910 |
-y,x-y+1,z |
2_565 |
3 |
1 |
395 |
35.2 |
-3.6 |
0.464 |
0 |
0 |
0 |
0.025 |
39 |
48 |
|
[MG]B:908 |
1 |
1 |
98 |
f |
B |
-y,x-y+1,z |
2_565 |
7 |
3 |
25006 |
33.4 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.025 |
40 |
49 |
|
[MG]B:908 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
25006 |
30.2 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.024 |
41 |
50 |
|
[HLA]A:906 |
3 |
1 |
362 |
f |
[SO4]B:902 |
x,y,z |
1_555 |
2 |
1 |
185 |
29.9 |
-4.0 |
0.494 |
0 |
0 |
0 |
0.028 |
42 |
51 |
|
[GLA]A:908 |
3 |
1 |
294 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
24845 |
29.9 |
0.8 |
0.521 |
1 |
0 |
0 |
0.000 |
43 |
52 |
|
[GLA]B:913 |
3 |
1 |
291 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
25006 |
26.7 |
0.7 |
0.516 |
0 |
0 |
0 |
0.000 |
44 |
53 |
|
[HLA]A:906 |
3 |
1 |
362 |
f |
[SO4]B:901 |
x,y,z |
1_555 |
2 |
1 |
187 |
19.0 |
-2.7 |
0.381 |
0 |
0 |
0 |
0.019 |
45 |
54 |
|
[FUC]A:909 |
1 |
1 |
281 |
f |
[BDP]A:907 |
x,y,z |
1_555 |
1 |
1 |
302 |
10.2 |
0.5 |
0.342 |
0 |
0 |
0 |
0.000 |
55 |
|
[FUC]B:914 |
1 |
1 |
280 |
f |
[BDP]B:912 |
x,y,z |
1_555 |
1 |
1 |
305 |
9.2 |
0.4 |
0.289 |
0 |
0 |
0 |
0.000 |
Average: |
9.7 |
0.4 |
0.315 |
0 |
0 |
0 |
0.000 |
46 |
56 |
|
[FUC]A:910 |
1 |
1 |
281 |
f |
[GLA]A:908 |
x,y,z |
1_555 |
1 |
1 |
294 |
10.0 |
0.1 |
0.302 |
0 |
0 |
0 |
0.000 |
47 |
57 |
|
[FUC]B:915 |
1 |
1 |
283 |
f |
[GLA]B:913 |
x,y,z |
1_555 |
1 |
1 |
291 |
9.2 |
0.1 |
0.270 |
0 |
0 |
0 |
0.000 |
48 |
58 |
|
[SO4]B:902 |
3 |
1 |
185 |
f |
[SO4]B:901 |
x,y,z |
1_555 |
1 |
1 |
187 |
8.9 |
-2.0 |
0.891 |
0 |
0 |
0 |
0.014 |
49 |
59 |
|
[SO4]A:902 |
3 |
1 |
185 |
f |
[SO4]A:901 |
x,y,z |
1_555 |
1 |
1 |
186 |
7.5 |
-1.7 |
0.891 |
0 |
0 |
0 |
0.014 |
50 |
60 |
|
[HLA]A:906 |
1 |
1 |
362 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
25006 |
5.4 |
0.1 |
0.484 |
0 |
0 |
0 |
0.000 |
51 |
61 |
|
[BGC]B:916 |
1 |
1 |
306 |
f |
[FUC]B:914 |
x,y,z |
1_555 |
1 |
1 |
280 |
1.9 |
0.1 |
0.183 |
0 |
0 |
0 |
0.000 |
52 |
62 |
|
[BGC]A:911 |
1 |
1 |
305 |
f |
[FUC]A:909 |
x,y,z |
1_555 |
1 |
1 |
281 |
1.6 |
0.1 |
0.183 |
0 |
0 |
0 |
0.000 |
|