Structure of PDB 1z03 Chain D Binding Site BS03
Receptor Information
>1z03 Chain D (length=427) Species:
303
(Pseudomonas putida) [
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ISDARANNAKTQSQYQPYKDAAWGFINHWYPALFTHELEEDQVQGIQICG
VPIVLRRVNGKVFALKDQCLHRGVRLSEKPTCFTKSTISCWYHGFTFDLE
TGKLVTIVANPEDKLIGTTGVTTYPVHEVNGMIFVFVREDDFPDEDVPPL
AHDLPFRFPERSEQFPHPLWPSSPSVLDDNAVVHGMHRTGFGNWRIACEN
GFDNAHILVHKDNTIVHAMDWVLPLGLLPTSDDCIAVVEDDDGPKGMMQW
LFTDKWAPVLENQELGLKVEGLKGRHYRTSVVLPGVLMVENWPEEHVVQY
EWYVPITDDTHEYWEILVRVCPTDEDRKKFQYRYDHMYKPLCLHGFNDSD
LYAREAMQNFYYDGTGWDDEQLVATDISPITWRKLASRWNRGIAKPGRGV
AGAVKDTSLIFKQTADGKRPGYKVEQI
Ligand information
Ligand ID
OCH
InChI
InChI=1S/C9H7NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11)
InChIKey
LISFMEBWQUVKPJ-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
c1ccc2c(c1)C=CC(=O)N2
CACTVS 3.341
O=C1Nc2ccccc2C=C1
ACDLabs 10.04
O=C2C=Cc1c(cccc1)N2
Formula
C9 H7 N O
Name
QUINOLIN-2(1H)-ONE;
2-OXOQUINOLINE
ChEMBL
CHEMBL186422
DrugBank
DB04745
ZINC
ZINC000008579298
PDB chain
1z03 Chain D Residue 4603 [
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Receptor-Ligand Complex Structure
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PDB
1z03
2-Oxoquinoline 8-Monooxygenase Oxygenase Component: Active Site Modulation by Rieske-[2Fe-2S] Center Oxidation/Reduction
Resolution
1.8 Å
Binding residue
(original residue number in PDB)
G216 V304 W307 Q314
Binding residue
(residue number reindexed from 1)
G201 V289 W292 Q299
Annotation score
5
Enzymatic activity
Enzyme Commision number
1.14.13.61
: 2-hydroxyquinoline 8-monooxygenase.
Gene Ontology
Molecular Function
GO:0004497
monooxygenase activity
GO:0042802
identical protein binding
GO:0046872
metal ion binding
GO:0051537
2 iron, 2 sulfur cluster binding
View graph for
Molecular Function
External links
PDB
RCSB:1z03
,
PDBe:1z03
,
PDBj:1z03
PDBsum
1z03
PubMed
15893671
UniProt
O05935
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