Structure of PDB 2vou Chain A Binding Site BS02

Receptor Information
>2vou Chain A (length=393) Species: 29320 (Paenarthrobacter nicotinovorans) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SPTTDRIAVVGGSISGLTAALMLRDAGVDVDVYERSPQPLSGFGTGIVVQ
PELVHYLLEQGVELDSISVPSSSMEYVDALTGERVGSVPADWRFTSYDSI
YGGLYELFGPERYHTSKCLVGLSQDSETVQMRFSDGTKAEANWVIGADGG
ASVVRKRLLGIEPTYAGYVTWRGVLQPGEVADDVWNYFNDKFTYGLLDDG
HLIAYPIPGRENAESPRLNFQWYWNVAEGPDLDELMTDVRGIRLPTSVHN
NSLNPHNLRQFHSKGESLFKPFRDLVLNASSPFVTVVADATVDRMVHGRV
LLIGDAAVTPRPHAAAGGAKASDDARTLAEVFTKNHDLRGSLQSWETRQL
QQGHAYLNKVKKMASRLQHGGSFEPGNPAFAFGLPKVDEPSVV
Ligand information
Ligand IDGOL
InChIInChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2
InChIKeyPEDCQBHIVMGVHV-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0C(C(CO)O)O
ACDLabs 12.01
CACTVS 3.370		OCC(O)CO
FormulaC3 H8 O3
NameGLYCEROL;
GLYCERIN;
PROPANE-1,2,3-TRIOL
ChEMBLCHEMBL692
DrugBankDB09462
ZINCZINC000000895048
PDB chain2vou Chain A Residue 1396 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB2vou Structure of 2,6-Dihydroxypyridine 3-Hydroxylase from a Nicotine-Degrading Pathway.
Resolution2.6 Å
Binding residue
(original residue number in PDB)		Y206 Q222 Y224 P313
Binding residue
(residue number reindexed from 1)		Y205 Q221 Y223 P312
Annotation score1
Enzymatic activity
Enzyme Commision number 1.14.13.10: 2,6-dihydroxypyridine 3-monooxygenase.
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0016491 oxidoreductase activity
GO:0018663 2,6-dihydroxypyridine 3-monooxygenase activity
GO:0042803 protein homodimerization activity
GO:0050660 flavin adenine dinucleotide binding
GO:0071949 FAD binding
Biological Process
GO:0019608 nicotine catabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:2vou, PDBe:2vou, PDBj:2vou
PDBsum2vou
PubMed18440023
UniProtQ93NG3|DHPH_PAENI 2,6-dihydroxypyridine 3-monooxygenase (Gene Name=dhpH)

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