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Structure Report for: 7AWH

Name|Crystal structure of human butyrylcholinesterase in complex with compound 54 tert-butyl 3-(((2-((1-(benzenesulfonyl)-1H-indol-4-yl)oxy)ethyl)amino)methyl)piperidine-1-carboxylate
Revelation date|29-Sep-2021
Family|BCHE: there are 91 genes in this family, 91 structure(s)
Gene_locus|human-BCHE
PDB File|ESTHER: header of PDB entry RCSB: Full entry
Comment|
Ligand|Inhibitor: Cpd54-BChEin-5-HT6 Ligand in structure: Ligplot


Reference

    Title: Development and crystallography-aided SAR studies of multifunctional BuChE inhibitors and 5-HT6R antagonists with beta-amyloid anti-aggregation properties
    Wichur T, Godyn J, Goral I, Latacz G, Bucki A, Siwek A, Gluch-Lutwin M, Mordyl B, Sniecikowska J and Wieckowska A <8 more author(s)>
    Ref: Eur Journal of Medicinal Chemistry, 225:113792, 2021 : PubMed

            



Representative scheme of BCHE structure and an image from PDBsum server



Databases

PDB-Sum7AWH Previously Class, Architecture, Topology and Homologous superfamily - PDB-Sum server
FSSP7AWH Fold classification based on Structure-Structure alignment of Proteins - FSSP server
SCOP7AWH Structural Classification Of Protein - SCOP server
PROTEOPEDIA7awh 3D, interactive encyclopedia of proteins - PROTEOPEDIA server



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Mail to: Nicolas Lenfant, Thierry Hotelier, Yves Bourne, Pascale Marchot and Arnaud Chatonnet.
Please cite: Lenfant 2013 Nucleic.Acids.Res. or Marchot Chatonnet 2012 Prot.Pept Lett.
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