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BioLiP

Structure of PDB 1gt1 Chain B Binding Site BS02

Receptor Information
>1gt1 Chain B (length=155) Species: 9913 (Bos taurus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EEEAEQNLSELSGPWRTVYIGSTNPEKIQENGPFRTYFRELVFDDEKGTV
DFYFSVKRDGKWKNVHVKATKQDDGTYVADYEGQNVFKIVSLSRTHLVAH
NINVDKHGQTTELTELFVKLNVEDEDLEKFWKLTEDKGIDKKNVVNFLEN
ENHPH
Ligand information
Ligand ID3OM
InChIInChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h4,8-9H,2-3,5-7H2,1H3/t8-/m1/s1
InChIKeyVSMOENVRRABVKN-MRVPVSSYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.6CCCCC[C@@H](C=C)O
CACTVS 3.385CCCCC[CH](O)C=C
ACDLabs 12.01OC(/C=C)CCCCC
CACTVS 3.385CCCCC[C@H](O)C=C
OpenEye OEToolkits 1.7.6CCCCCC(C=C)O
FormulaC8 H16 O
Name(3S)-1-octen-3-ol
ChEMBL
DrugBankDB03025
ZINCZINC000002026960
PDB chain1gt1 Chain B Residue 1159 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1gt1 Crystal Structures of Bovine Odorant-Binding Protein in Complex with Odorant Molecules.
Resolution1.71 Å
Binding residue
(original residue number in PDB)
I22 F36 T38 N87 N103
Binding residue
(residue number reindexed from 1)
I20 F34 T36 N85 N101
Annotation score1
Binding affinityMOAD: Kd=1.2uM
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005549 odorant binding
GO:0036094 small molecule binding
Biological Process
GO:0007608 sensory perception of smell
Cellular Component
GO:0005576 extracellular region
GO:0005615 extracellular space

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Molecular Function

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Biological Process

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Cellular Component
External links
PDB RCSB:1gt1, PDBe:1gt1, PDBj:1gt1
PDBsum1gt1
PubMed15373829
UniProtP07435|OBP_BOVIN Odorant-binding protein

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