Structure of PDB 1lw5 Chain D Binding Site BS03 |
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Ligand ID | PLG |
InChI | InChI=1S/C10H15N2O7P/c1-6-10(15)8(3-11-4-9(13)14)7(2-12-6)5-19-20(16,17)18/h2,11,15H,3-5H2,1H3,(H,13,14)(H2,16,17,18) |
InChIKey | FEVQWBMNLWUBTF-UHFFFAOYSA-N |
SMILES | Software | SMILES |
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CACTVS 3.341 | Cc1ncc(CO[P](O)(O)=O)c(CNCC(O)=O)c1O | ACDLabs 10.04 | O=P(O)(O)OCc1cnc(c(O)c1CNCC(=O)O)C | OpenEye OEToolkits 1.5.0 | Cc1c(c(c(cn1)COP(=O)(O)O)CNCC(=O)O)O |
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Formula | C10 H15 N2 O7 P |
Name | N-GLYCINE-[3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-PYRIDIN-4-YL-METHANE]; N-PYRIDOXYL-GLYCINE-5-MONOPHOSPHATE |
ChEMBL | |
DrugBank | DB02824 |
ZINC | ZINC000002046831
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PDB chain | 1lw5 Chain D Residue 1002
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Enzyme Commision number |
4.1.2.5: L-threonine aldolase. |
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