Structure of PDB 8bxw Chain AAA Binding Site BS01
Receptor Information
>8bxw Chain AAA (length=123) Species:
7165
(Anopheles gambiae) [
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AMTRKQLINSMDMMRSACAPKFKVSTEMLDNLRGGIFAEDRELKCYTMCI
AQMAGTMNKKGEINVQKTLAQMDAMLPPDMRDKAKEAIHSCRDVQGRYKD
SCDKTFYSTKCLAEYDRDVFLFP
Ligand information
Ligand ID
1BO
InChI
InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3
InChIKey
LRHPLDYGYMQRHN-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
OpenEye OEToolkits 1.5.0
CCCCO
ACDLabs 10.04
OCCCC
Formula
C4 H10 O
Name
1-BUTANOL;
BUTAN-1-OL
ChEMBL
CHEMBL14245
DrugBank
DB02145
ZINC
ZINC000001530354
PDB chain
8bxw Chain AAA Residue 302 [
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Receptor-Ligand Complex Structure
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PDB
8bxw
The structure of AgamOBP5 in complex with the natural insect repellents Carvacrol and Thymol: Crystallographic, fluorescence and thermodynamic binding studies.
Resolution
1.3 Å
Binding residue
(original residue number in PDB)
K21 C49 Q52
Binding residue
(residue number reindexed from 1)
K21 C49 Q52
Annotation score
3
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
PDBsum
8bxw
PubMed
36921814
UniProt
Q8T6R6
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