Structure of PDB 8z9a Chain D Binding Site BS01
Receptor Information
>8z9a Chain D (length=357) Species:
7029
(Acyrthosiphon pisum) [
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IDTINMFLQMTGCTDSKAMLYLTYFEFLITFYYLIATYASIVHFEQSVTI
QLFALLCMLIECVILLNITFRLYHKNHIREMHQYSRRLGIPDSYRSVINV
ITKYHLIASNIFVVFPVTYAIFCDSVRVGDPFTFPFLDVLPMHTDNLAIY
ACKYLVYAISVYIAHVELCFINTTFIYYVGVLKHRLETIVQTIGEAFADN
DEQKFKYAIIQHQKLLSYFNTMKIVFSKPILLSMSFNAIYFGLTTSFVIQ
AIRGYINQAILSICIASSAAAVINITIYTFYGSELMDLHDKILHVLFDNA
FFYVSKSFKSSILIMMTRVTIPLKFTVGYIFTINLNLLLKILKMSYTVLN
VLLSSET
Ligand information
Ligand ID
SOU
InChI
InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8+
InChIKey
HIGQPQRQIQDZMP-DHZHZOJOSA-N
SMILES
Software
SMILES
CACTVS 3.385
CC(=O)OC\C=C(/C)CCC=C(C)C
OpenEye OEToolkits 2.0.7
CC(=CCCC(=CCOC(=O)C)C)C
OpenEye OEToolkits 2.0.7
CC(=CCC/C(=C/COC(=O)C)/C)C
CACTVS 3.385
CC(=O)OCC=C(C)CCC=C(C)C
Formula
C12 H20 O2
Name
[(2E)-3,7-dimethylocta-2,6-dienyl] ethanoate
ChEMBL
DrugBank
ZINC
PDB chain
8z9a Chain D Residue 402 [
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Receptor-Ligand Complex Structure
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PDB
8z9a
Structural basis for odorant recognition of the insect odorant receptor OR-Orco heterocomplex.
Resolution
3.0 Å
Binding residue
(original residue number in PDB)
I63 V164 A269 S270
Binding residue
(residue number reindexed from 1)
I60 V161 A266 S267
Annotation score
1
Gene Ontology
Molecular Function
GO:0004984
olfactory receptor activity
Biological Process
GO:0007165
signal transduction
GO:0007608
sensory perception of smell
GO:0050911
detection of chemical stimulus involved in sensory perception of smell
Cellular Component
GO:0005886
plasma membrane
GO:0016020
membrane
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:8z9a
,
PDBe:8z9a
,
PDBj:8z9a
PDBsum
8z9a
PubMed
38870272
UniProt
A0A1S6J146
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