PDB Entry (2dvu)

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PDB ID: 2dvu Resolution: 1.9 Å Exp. Method: X-RAY DIFFRACTION
PMID: - DOI: None
Protein
Protein Name: Thermophilic reversible gamma-resorcylate decarboxylase
Protein Class: LYASE
Uniprot ID/ACC: Q60GU1 (Q60GU1_9RHIZ) Organism: Rhizobium
Gene Symbol: - Gene ID: -
Pocket Descriptors
Volume: 765.12 Depth: 48.1064
Hydrophobicity: 0.686747 Drug Score: 0.613532
Pocket Similarity: Calculate
Ligand
Ligand Name:   2,6-DIHYDROXYBENZOIC ACID
HET ID:   GRE PubChem:   9338
DrugBank:   - ChEMBL:   CHEMBL454808
Canonical SMILES:   OC(=O)c1c(O)cccc1O
Standard InChI:   InChI=1S/C7H6O4/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3,8-9H,(H,10,11)
Molecular Formula:   C7H6O4 Mol. Weight:   154.12013 Heavy Atoms:   11
Charge:   0 Is Chiral:   False logP:   0.796
HBD:   3 HBA:   4 TPSA:   77.76
#Bonds:   11 #Rotatable Bonds:   1 Shape Complexity:   0.0
Stereocomplexity:   0.0 Ligand Type:   Small Molecule
Binding Affinity
-