Structure of PDB 5muj Chain A Binding Site BS02 |
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| Ligand ID | 8PK |
| InChI | InChI=1S/C9H18O6/c1-4-7(15-5(2)10)6(11)8(13-3)9(12)14-4/h4-12H,1-3H3/t4-,5+,6+,7+,8-,9+/m0/s1 |
| InChIKey | MOOIWRPNHMPYOB-BARZSYDPSA-N |
| SMILES | | Software | SMILES |
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| OpenEye OEToolkits 2.0.6 | C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O)OC)O)O[C@H](C)O | | OpenEye OEToolkits 2.0.6 | CC1C(C(C(C(O1)O)OC)O)OC(C)O | | CACTVS 3.385 | CO[CH]1[CH](O)O[CH](C)[CH](O[CH](C)O)[CH]1O | | CACTVS 3.385 | CO[C@@H]1[C@H](O)O[C@@H](C)[C@@H](O[C@H](C)O)[C@H]1O |
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| Formula | C9 H18 O6 |
| Name | 4-O-[(1R)-1-hydroxyethyl]-2-O-methyl-alpha-L-fucopyranose;
2-O-methyl, 4-O-Acetyl-alpha-L-fucosepyranose;
6-deoxy-4-O-[(1R)-1-hydroxyethyl]-2-O-methyl-alpha-L-galactopyranose;
4-O-[(1R)-1-hydroxyethyl]-2-O-methyl-alpha-L-fucose;
4-O-[(1R)-1-hydroxyethyl]-2-O-methyl-L-fucose;
4-O-[(1R)-1-hydroxyethyl]-2-O-methyl-fucose |
| ChEMBL | |
| DrugBank | |
| ZINC |
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| PDB chain | 5muj Chain B Residue 8
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