Structure of PDB 1n8v Chain B Binding Site BS01

Receptor Information
>1n8v Chain B (length=103) Species: 55057 (Mamestra brassicae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EDKYTDKYDNINLDEILANKRLLVAYVNCVMERGKCSPEGKELKEHLQDA
IENGCKKCTENQEKGAYRVIEHLIKNEIEIWRELTAKYDPTGNWRKKYED
RAK
Ligand information
Ligand IDBDD
InChIInChI=1S/C12H25BrO/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h14H,1-12H2
InChIKeyASIDMJNTHJYVQJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04BrCCCCCCCCCCCCO
OpenEye OEToolkits 1.5.0C(CCCCCCBr)CCCCCO
CACTVS 3.341OCCCCCCCCCCCCBr
FormulaC12 H25 Br O
NameBROMO-DODECANOL
ChEMBLCHEMBL1231267
DrugBankDB02619
ZINCZINC000002047662
PDB chain1n8v Chain B Residue 511 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB1n8v Moth chemosensory protein exhibits drastic conformational changes and cooperativity on ligand binding.
Resolution1.39 Å
Binding residue
(original residue number in PDB)		Y8 D9 Y26 V30 E39 L43 Q62
Binding residue
(residue number reindexed from 1)		Y8 D9 Y26 V30 E39 L43 Q62
Annotation score1
Binding affinityMOAD: Kd=0.93uM
Enzymatic activity
Enzyme Commision number ?
External links