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Structure Report for: 7Q1M

Name|Crystal structure of human butyrylcholinesterase in complex with N-[(2S)-3-[(cyclohexylmethyl)amino]-2-hydroxypropyl]-2,2-diphenylacetamide
Revelation date|16-Nov-2022
Family|BCHE: there are 125 genes in this family, 91 structure(s)
Gene_locus|human-BCHE
PDB File|ESTHER: header of PDB entry RCSB: Full entry
Comment|
Brazzolotto, X.,Panek, D.,Pasieka, A.,Malawska, B.,Nachon, F.
Ligand|Inhibitor: 8IS-7Q1M Ligand in structure: Ligplot


Reference

    Title: Discovery of new, highly potent and selective inhibitors of BuChE - Design, synthesis, in vitro and in vivo evaluation and crystallography studies
    Panek D, Pasieka A, Latacz G, Zareba P, Szczech M, Godyn J, Chantegreil F, Nachon F, Brazzolotto X and Malawska B <7 more author(s)>
    Ref: Eur Journal of Medicinal Chemistry, 249:115135, 2023 : PubMed

            



Representative scheme of BCHE structure and an image from PDBsum server



Databases

PDB-Sum7Q1M Previously Class, Architecture, Topology and Homologous superfamily - PDB-Sum server
FSSP7Q1M Fold classification based on Structure-Structure alignment of Proteins - FSSP server
SCOP7Q1M Structural Classification Of Protein - SCOP server
PROTEOPEDIA7q1m 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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