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Structure Report for: 5K5E

Name|Discovery and Structure-Activity Relationships of a Highly Selective Butyrylcholinesterase Inhibitor by Structure-Based Virtual Screening (5JYW withdrawn)
Revelation date|27-Jul-2016
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|
De la Mora, E., Dighe, S.N., Deora, G.S., Ross, B.P., Nachon, F., Brazzolotto, X.
Ligand|Inhibitor: ST052207 Ligand in structure: Ligplot


Reference

    Title: Discovery and Structure-Activity Relationships of a Highly Selective Butyrylcholinesterase Inhibitor by Structure-Based Virtual Screening
    Dighe SN, Deora GS, De la Mora E, Nachon F, Chan S, Parat MO, Brazzolotto X, Ross BP
    Ref: Journal of Medicinal Chemistry, 59:7683, 2016 : PubMed

            



Representative scheme of BCHE structure and an image from PDBsum server



Databases

PDB-Sum5K5E Previously Class, Architecture, Topology and Homologous superfamily - PDB-Sum server
FSSP5K5E Fold classification based on Structure-Structure alignment of Proteins - FSSP server
SCOP5K5E Structural Classification Of Protein - SCOP server
PROTEOPEDIA5k5e 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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