Structure of PDB 1h0j Chain C Binding Site BS01

Receptor Information
>1h0j Chain C (length=60) Species: 8656 (Naja atra) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LKCNKLVPLFYKTCPAGKNLCYKMFMVATPKVPVKRGCIDVCPKSSLLVK
YVCCNTDRCN
Ligand information
Ligand IDSDS
InChIInChI=1S/C12H26O4S/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h2-12H2,1H3,(H,13,14,15)
InChIKeyMOTZDAYCYVMXPC-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341CCCCCCCCCCCCO[S](O)(=O)=O
OpenEye OEToolkits 1.5.0CCCCCCCCCCCCOS(=O)(=O)O
ACDLabs 10.04O=S(=O)(OCCCCCCCCCCCC)O
FormulaC12 H26 O4 S
NameDODECYL SULFATE
ChEMBLCHEMBL1204779
DrugBankDB03967
ZINCZINC000001532179
PDB chain1h0j Chain C Residue 1062 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1h0j Structural Basis of Membrane-Induced Cardiotoxin A3 Oligomerization
Resolution1.9 Å
Binding residue
(original residue number in PDB)
T29 K31 V32
Binding residue
(residue number reindexed from 1)
T29 K31 V32
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0031640 killing of cells of another organism
GO:0035821 modulation of process of another organism
Cellular Component
GO:0005576 extracellular region
GO:0016020 membrane
GO:0044218 other organism cell membrane

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Molecular Function

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Biological Process

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Cellular Component
External links
PDB RCSB:1h0j, PDBe:1h0j, PDBj:1h0j
PDBsum1h0j
PubMed12660250
UniProtP60301|3SA3_NAJAT Cytotoxin 3

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