Ligand |
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Ligand Name: (6-ethynyl-4-methanoyl-5-oxidanyl-pyridin-3-yl)methyl dihydrogen phosphate | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB760 | PubChem: - | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: - | |
Canonical SMILES: Oc1c(C=O)c(COP(O)(O)=O)cnc1C#C | ||
Standard InChI: InChI=1S/C9H8NO6P/c1-2-8-9(12)7(4-11)6(3-10-8)5-16-17(13,14)15/h1,3-4,12H,5H2,(H2,13,14,15) | ||
Molecular Formula: C9H8NO6P | Mol. Weight: 257.0089 | logP: 0.1903 |
HBD: 3 | HBA: 5 | |
#Rotatable Bonds: 4 | TPSA: 116.95 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Alanine racemase 1 | P63479 (ALR1_STAAM) | Staphylococcus aureus (strain Mu50 / ATCC 700699) | 6G59 | EM2 |
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