Structure of PDB 4bv7 Chain A Binding Site BS01

Receptor Information
>4bv7 Chain A (length=79) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QCYHGNGQSYRGTFSTTVTGRTCQSWSSMTPHRHQRTPENYPNDGLTMNY
CRNPDADTGPWCFTMDPSIRWEYCALTRC
Ligand information
Ligand IDBV7
InChIInChI=1S/C8H15NO2/c10-8(11)2-1-7-3-5-9-6-4-7/h7,9H,1-6H2,(H,10,11)
InChIKeyAUYQMCCWFNSFGV-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.6C1CNCCC1CCC(=O)O
ACDLabs 12.01O=C(O)CCC1CCNCC1
CACTVS 3.385OC(=O)CCC1CCNCC1
FormulaC8 H15 N O2
Name3-(4-piperidyl)propanoic acid
ChEMBLCHEMBL110858
DrugBank
ZINCZINC000004204051
PDB chain4bv7 Chain A Residue 1083 [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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PDB4bv7 Small Molecules Used to Decipher the Pathophysiological Roles of the Kringle Domains Kiv-7, - 10 and Kv of Apolipoprotein(A)
Resolution1.7 Å
Binding residue
(original residue number in PDB)		D55 D57 W62 F64 R71 W72
Binding residue
(residue number reindexed from 1)		D55 D57 W61 F63 R70 W71
Annotation score1
Enzymatic activity
Enzyme Commision number 3.4.21.-
External links
PDB RCSB:4bv7, PDBe:4bv7, PDBj:4bv7
PDBsum4bv7
PubMed
UniProtP08519|APOA_HUMAN Apolipoprotein(a) (Gene Name=LPA)

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