Structure of PDB 3d73 Chain A Binding Site BS01
Receptor Information
>3d73 Chain A (length=119) Species:
7460
(Apis mellifera) [
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APDWVPPEVFDLVAEDKARCMSEHGTTQAQIDDVAKGNLVNEPSITCYMY
CLLEAFSLVDDEANVDEDIMLGLLPDQLQERAQSVMGKCLPTSGSDNCNK
IYNLAKCVQESAPDVWFVI
Ligand information
Ligand ID
NBB
InChI
InChI=1S/C10H15NO2S/c1-2-3-9-11-14(12,13)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3
InChIKey
IPRJXAGUEGOFGG-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
CCCCNS(=O)(=O)c1ccccc1
CACTVS 3.341
CCCCN[S](=O)(=O)c1ccccc1
ACDLabs 10.04
O=S(=O)(NCCCC)c1ccccc1
Formula
C10 H15 N O2 S
Name
N-BUTYL-BENZENESULFONAMIDE
ChEMBL
CHEMBL479880
DrugBank
DB02055
ZINC
ZINC000001666831
PDB chain
3d73 Chain A Residue 120 [
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Receptor-Ligand Complex Structure
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PDB
3d73
Queen bee pheromone binding protein pH-induced domain swapping favors pheromone release
Resolution
2.03 Å
Binding residue
(original residue number in PDB)
M49 L52 L53 M70 W116 F117 V118
Binding residue
(residue number reindexed from 1)
M49 L52 L53 M70 W116 F117 V118
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0005549
odorant binding
View graph for
Molecular Function
External links
PDB
RCSB:3d73
,
PDBe:3d73
,
PDBj:3d73
PDBsum
3d73
PubMed
19481550
UniProt
Q9U9J6
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