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Structure Report for: 7AIT

Name|Crystal structure of Torpedo Californica acetylcholinesterase in complex with 7-[(3-Chloro-6,7,10,11-tetrahydro-9-methyl-7,11-methanocycloocta[b]quinolin-12-yl)amino]-N-(4-hydroxy-3-methoxybenzyl)heptanamide compound 5c
Revelation date|06-Oct-2021
Family|ACHE: there are 538 genes in this family, 315 structure(s)
Gene_locus|torca-ACHE
PDB File|ESTHER: header of PDB entry RCSB: Full entry
Comment|
Coquelle, N.,Colletier, J.P.
Ligand|Inhibitor: 8UK-7AIT-compound5c Ligand in structure: Ligplot


Reference

    Title: Discovery of a Potent Dual Inhibitor of Acetylcholinesterase and Butyrylcholinesterase with Antioxidant Activity that Alleviates Alzheimer-like Pathology in Old APP/PS1 Mice
    Viayna E, Coquelle N, Cieslikiewicz-Bouet M, Cisternas P, Oliva CA, Sanchez-Lopez E, Ettcheto M, Bartolini M, De Simone A and Munoz-Torrero D <16 more author(s)>
    Ref: Journal of Medicinal Chemistry, 64:812, 2021 : PubMed

            



Representative scheme of ACHE structure and an image from PDBsum server



Databases

PDB-Sum7AIT Previously Class, Architecture, Topology and Homologous superfamily - PDB-Sum server
FSSP7AIT Fold classification based on Structure-Structure alignment of Proteins - FSSP server
SCOP7AIT Structural Classification Of Protein - SCOP server
PROTEOPEDIA7ait 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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