Structure of PDB 4h2q Chain A Binding Site BS02

Receptor Information
>4h2q Chain A (length=370) Species: 266835 (Mesorhizobium japonicum MAFF 303099) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KTRRAEVAGGGFAGLTAAIALKQNGWDVRLHEKSSELRAFGAGIYLWHNG
LRVLEGLGALDDVLQGSHTPPTYETWMHNKSVSKETFNGLPWRIMTRSHL
HDALVNRARALGVDISVNSEAVAADPVGRLTLQTGEVLEADLIVGADGVG
SKVRDSIGFKQDRWVSKDGLIRLIVPRMKKELGHGEWDNTIDMWNFWPRV
QRILYSPCNENELYLGLMAPAADPRGSSVPIDLEVWVEMFPFLEPCLIEA
AKLKTARYDKYETTKLDSWTRGKVALVGDAAHAMCPALAQGAGCAMVNAF
SLSQDLEEGSSVEDALVAWETRIRPITDRCQALSGDYAANRSLSKGNMFT
PAALEAARYDPLRRVYSWPQ
Ligand information
Ligand ID5HN
InChIInChI=1S/C6H5NO3/c8-5-1-4(6(9)10)2-7-3-5/h1-3,8H,(H,9,10)
InChIKeyATTDCVLRGFEHEO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.370Oc1cncc(c1)C(O)=O
ACDLabs 12.01O=C(O)c1cncc(O)c1
OpenEye OEToolkits 1.7.6c1c(cncc1O)C(=O)O
FormulaC6 H5 N O3
Name5-hydroxypyridine-3-carboxylic acid;
5-Hydroxynicotinic Acid
ChEMBLCHEMBL2146902
DrugBank
ZINCZINC000000332673
PDB chain4h2q Chain A Residue 403 [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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PDB4h2q Crystal structure of 2-Methyl-3-hydroxypyridiine-5-carboxylic acid oxygenase
Resolution1.502 Å
Binding residue
(original residue number in PDB)		R211 L213 P295 A296 L352
Binding residue
(residue number reindexed from 1)		R202 L204 P286 A287 L343
Annotation score1
Enzymatic activity
Enzyme Commision number 1.14.12.4: Transferred entry: 1.14.13.242.
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0004497 monooxygenase activity
GO:0071949 FAD binding

View graph for
Molecular Function
External links
PDB RCSB:4h2q, PDBe:4h2q, PDBj:4h2q
PDBsum4h2q
PubMed
UniProtQ988D3

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