Ligand |
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Ligand Name: (R)-Alpha-phenylglycidate | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB504 | PubChem: - | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: - | |
Canonical SMILES: [O-]C(=O)[C@@]1(CO1)c2ccccc2 | ||
Standard InChI: InChI=1S/C9H8O3/c10-8(11)9(6-12-9)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11)/p-1/t9-/m1/s1 | ||
Molecular Formula: C9H7O3- | Mol. Weight: 163.04007 | logP: -0.338 |
HBD: 0 | HBA: 3 | |
#Rotatable Bonds: 2 | TPSA: 52.66 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Mandelate racemase | P11444 (MANR_PSEPU) | Pseudomonas putida (Arthrobacter siderocapsulatus) | 1MNS | APG | Ki : 67000 nM | PDBBind | SHOW |