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- Structure Biounit | Ligand Information
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1331 families. | |||||
1 | 4WA2 | Kd = 14.19 uM | NAG GAL SIA | n/a | n/a |
2 | 2YP8 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
3 | 2YP9 | - | SIA CMO | n/a | n/a |
4 | 2YP4 | - | BGC GAL NAG GAL SIA | n/a | n/a |
5 | 4WEA | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
6 | 2YP5 | - | GAL SIA | n/a | n/a |
7 | 2YP3 | - | NAG GAL SIA | n/a | n/a |
8 | 5XLA | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
9 | 5XL9 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 322 families. | |||||
1 | 2WR1 | - | NAG GAL SIA | n/a | n/a |
2 | 2WR4 | - | NAG GAL SIA | n/a | n/a |
3 | 2WR2 | - | NAG GAL SIA | n/a | n/a |
4 | 2WR3 | - | NAG GAL SIA | n/a | n/a |
5 | 2WR7 | - | GAL NAG GAL SIA | n/a | n/a |
6 | 4WA2 | Kd = 14.19 uM | NAG GAL SIA | n/a | n/a |
7 | 2YP8 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
8 | 2YP9 | - | SIA CMO | n/a | n/a |
9 | 2YP4 | - | BGC GAL NAG GAL SIA | n/a | n/a |
10 | 4WEA | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
11 | 2YP5 | - | GAL SIA | n/a | n/a |
12 | 2YP3 | - | NAG GAL SIA | n/a | n/a |
13 | 5XLA | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
14 | 5XL9 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | SIA CMO | 1 | 1 |
2 | MNA | 0.75 | 0.979592 |
3 | SIA SIA | 0.64 | 0.87037 |
4 | GAL SIA | 0.635135 | 0.867925 |
5 | SLB SIA SIA | 0.631579 | 0.87037 |
6 | SLB SIA SIA SIA | 0.631579 | 0.87037 |
7 | SIA SIA SIA SIA SIA SIA SIA | 0.631579 | 0.87037 |
8 | SLB SIA SIA SIA SIA | 0.631579 | 0.87037 |
9 | SIA SIA SIA | 0.6125 | 0.87037 |
10 | 2FG SIA | 0.607595 | 0.807018 |
11 | SIA | 0.59375 | 0.877551 |
12 | SLB | 0.59375 | 0.877551 |
13 | MN0 | 0.588235 | 0.94 |
14 | NAG SIA | 0.5875 | 0.824561 |
15 | SID | 0.555556 | 0.901961 |
16 | CNP | 0.549296 | 0.777778 |
17 | NXD | 0.540541 | 0.87037 |
18 | 6KL | 0.536232 | 0.886792 |
19 | GAL SIA SIA | 0.516484 | 0.854545 |
20 | A2G GAL SIA | 0.51087 | 0.87037 |
21 | NAG GAL SIA | 0.505376 | 0.87037 |
22 | NAG 2FG SIA | 0.505263 | 0.810345 |
23 | GAL SIA NGA | 0.5 | 0.87037 |
24 | BND | 0.5 | 0.886792 |
25 | BGC GAL SIA | 0.5 | 0.851852 |
26 | MBG NGC | 0.5 | 0.886792 |
27 | MUS | 0.494382 | 0.775862 |
28 | WIA SIA | 0.494118 | 0.842105 |
29 | 42D | 0.492958 | 0.882353 |
30 | GAL 5N6 | 0.488636 | 0.90566 |
31 | NGA GAL SIA | 0.479592 | 0.886792 |
32 | 18D | 0.472222 | 0.843137 |
33 | GAL SIA NGA GAL SIA | 0.465347 | 0.87037 |
34 | GAL SIA NGA GAL | 0.465347 | 0.854545 |
35 | GAL NGA GAL SIA | 0.465347 | 0.87037 |
36 | SIA GAL NGA GAL | 0.465347 | 0.87037 |
37 | GAL NAG GAL SIA | 0.465347 | 0.854545 |
38 | MAG FUC GAL SIA | 0.461538 | 0.90566 |
39 | NDG GAL SIA SIA | 0.460784 | 0.824561 |
40 | NAG GAL SIA SIA | 0.460784 | 0.854545 |
41 | NGS GAL SIA | 0.456311 | 0.691176 |
42 | NAG GAL NGC | 0.455446 | 0.836364 |
43 | PH5 | 0.453488 | 0.803571 |
44 | 79J | 0.453333 | 0.9 |
45 | NAG FUC GAL SIA | 0.447619 | 0.87037 |
46 | NGE | 0.444444 | 0.86 |
47 | NGC | 0.444444 | 0.86 |
48 | EQP | 0.444444 | 0.706897 |
49 | AXP | 0.444444 | 0.706897 |
50 | C5P SIA | 0.444444 | 0.605263 |
51 | FSI | 0.444444 | 0.796296 |
52 | BGC GAL SIA NAG | 0.443396 | 0.87037 |
53 | BGC GAL SIA SIA | 0.439252 | 0.854545 |
54 | SFJ | 0.430556 | 0.777778 |
55 | BGC GAL SIA NGA GAL SIA | 0.427273 | 0.87037 |
56 | GAL NAG FUC GAL SIA | 0.423423 | 0.87037 |
57 | BGC GAL GLA NGA GAL SIA | 0.423423 | 0.87037 |
58 | BGC GAL SIA NGA GAL | 0.423423 | 0.87037 |
59 | NAG GAL NAG GAL SIA | 0.419643 | 0.854545 |
60 | BGC GAL NAG GAL SIA | 0.415929 | 0.854545 |
61 | GAL SIA NGA GAL SIA SIA | 0.412281 | 0.854545 |
62 | NGA POL GAL NGC AZI | 0.410714 | 0.686567 |
63 | GAL NGA GAL SIA SIA | 0.408696 | 0.854545 |
64 | NGS FUC GLA SIA | 0.408696 | 0.691176 |
65 | GLC GAL NGC | 0.405941 | 0.833333 |
66 | NAG GAL 5N6 | 0.40566 | 0.872727 |
This union binding pocket(no: 1) in the query (biounit: 2yp9.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |