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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 426 families. | |||||
1 | 3LEK | - | NDG GAL FUC FUC | n/a | n/a |
2 | 3LEG | - | NAG FUC GAL FUC | n/a | n/a |
3 | 3LEI | - | FUC | C6 H12 O5 | C[C@H]1[C@.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 322 families. | |||||
1 | 2J1U | - | BGC GAL FUC A2G | n/a | n/a |
2 | 2J1V | - | NAG GAL FUC | n/a | n/a |
3 | 2J1S | - | FUL | C6 H12 O5 | C[C@H]1[C@.... |
4 | 2J1T | Ka = 1000 M^-1 | NAG FUC GAL FUC | n/a | n/a |
5 | 3LEK | - | NDG GAL FUC FUC | n/a | n/a |
6 | 3LEG | - | NAG FUC GAL FUC | n/a | n/a |
7 | 3LEI | - | FUC | C6 H12 O5 | C[C@H]1[C@.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | NDG GAL FUC FUC | 1 | 1 |
2 | BGC GAL FUC | 0.605263 | 0.693878 |
3 | GLC GAL BGC FUC | 0.605263 | 0.693878 |
4 | NAG GAL FUC FUC | 0.571429 | 0.92 |
5 | NAG GAL FUC A2G | 0.554217 | 0.9 |
6 | NDG FUC GAL FUC | 0.552941 | 0.92 |
7 | XYS GAL FUC | 0.536585 | 0.68 |
8 | MAG GAL FUC FUC | 0.517241 | 0.901961 |
9 | GAL FUC NGA | 0.517241 | 0.979592 |
10 | NAG GAL FUC | 0.511628 | 0.9 |
11 | MAG FUC GAL FUC | 0.5 | 0.901961 |
12 | BGC FUC GAL | 0.5 | 0.693878 |
13 | GLC BGC FUC GAL | 0.5 | 0.693878 |
14 | GAL NAG GAL FUC FUC | 0.5 | 0.92 |
15 | GLA NAG GAL FUC | 0.473118 | 0.9 |
16 | BHE | 0.465116 | 0.614035 |
17 | BGC GAL FUC GLA | 0.460674 | 0.693878 |
18 | 4YA | 0.458824 | 0.614035 |
19 | GAL NAG GAL FUC | 0.458333 | 0.865385 |
20 | BGC GAL NAG GAL FUC FUC | 0.456311 | 0.92 |
21 | NAG FUC GAL | 0.454545 | 0.9 |
22 | BGC GAL NAG GAL FUC | 0.445545 | 0.9 |
23 | GAL FUC GAL | 0.433735 | 0.693878 |
24 | NAG GAL FUC GLA | 0.42268 | 0.9 |
25 | NAG NON FUC GAL FUC | 0.419048 | 0.793103 |
26 | NAG GAL FUC FUC A2G | 0.407767 | 0.884615 |
27 | MAN MAN MAN GLC | 0.406977 | 0.673469 |
28 | BGC FUC GAL FUC A2G | 0.405941 | 0.92 |
29 | BGC GAL FUC A2G | 0.401961 | 0.9 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | NAG FUC GAL FUC | 0.9593 |
This union binding pocket(no: 1) in the query (biounit: 3lek.bio1) has 10 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |