Structure of PDB 8bxw Chain AAA Binding Site BS02

Receptor Information
>8bxw Chain AAA (length=123) Species: 7165 (Anopheles gambiae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AMTRKQLINSMDMMRSACAPKFKVSTEMLDNLRGGIFAEDRELKCYTMCI
AQMAGTMNKKGEINVQKTLAQMDAMLPPDMRDKAKEAIHSCRDVQGRYKD
SCDKTFYSTKCLAEYDRDVFLFP
Ligand information
Ligand IDS5V
InChIInChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3
InChIKeyRECUKUPTGUEGMW-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385CC(C)c1ccc(C)c(O)c1
OpenEye OEToolkits 3.1.0.0Cc1ccc(cc1O)C(C)C
FormulaC10 H14 O
Name2-methyl-5-propan-2-yl-phenol
ChEMBLCHEMBL281202
DrugBankDB16404
ZINCZINC000000967563
PDB chain8bxw Chain AAA Residue 305 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8bxw The structure of AgamOBP5 in complex with the natural insect repellents Carvacrol and Thymol: Crystallographic, fluorescence and thermodynamic binding studies.
Resolution1.3 Å
Binding residue
(original residue number in PDB)		M14 A54 Q71 M72 M75
Binding residue
(residue number reindexed from 1)		M14 A54 Q71 M72 M75
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005549 odorant binding

View graph for
Molecular Function
External links
PDB RCSB:8bxw, PDBe:8bxw, PDBj:8bxw
PDBsum8bxw
PubMed36921814
UniProtQ8T6R6

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