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Structure Report for: 5NN0

Name|Human butyrylcholinesterase in complex with inhibitor with picomolar activity
Revelation date|14-Mar-2018
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|
Kosak U, Brus B, Knez D, akelj S, Trontelj J, Pilar A, Sink R, Jukic M, Zivin M, Podkowa A, Nachon F, Brazzolotto X, Stojan J, Kos J, Coquelle N, Salat K, Colletier JP, Gobec S
Ligand|Inhibitor: 5NN0-cpd3 Ligand in structure: Ligplot


Reference

    Title: The Magic of Crystal Structure-Based Inhibitor Optimization: Development of a Butyrylcholinesterase Inhibitor with Picomolar Affinity and in Vivo Activity
    Kosak U, Brus B, Knez D, Zakelj S, Trontelj J, Pislar A, Sink R, Jukic M, Zivin M and Gobec S <8 more author(s)>
    Ref: Journal of Medicinal Chemistry, 61:119, 2018 : PubMed

            



Representative scheme of BCHE structure and an image from PDBsum server



Databases

PDB-Sum5NN0 Previously Class, Architecture, Topology and Homologous superfamily - PDB-Sum server
FSSP5NN0 Fold classification based on Structure-Structure alignment of Proteins - FSSP server
SCOP5NN0 Structural Classification Of Protein - SCOP server
PROTEOPEDIA5nn0 3D, interactive encyclopedia of proteins - PROTEOPEDIA server



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Please cite: Lenfant 2013 Nucleic.Acids.Res. or Marchot Chatonnet 2012 Prot.Pept Lett.
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