Name : Human butyrylcholinesterase in complex with inhibitor with picomolar activity

Revelation date : 14-Mar-2018

Family : BCHE

Gene_locus : human-BCHE

PDB file : ESTHER: header of PDB entry RCSB: Full entry

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

References (1)

Title : The Magic of Crystal Structure-Based Inhibitor Optimization: Development of a Butyrylcholinesterase Inhibitor with Picomolar Affinity and in Vivo Activity - Kosak_2018_J.Med.Chem_61_119
Author(s) : Kosak U , Brus B , Knez D , Zakelj S , Trontelj J , Pislar 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
Ref : Journal of Medicinal Chemistry , 61 :119 , 2018
Abstract :
PubMedSearch : Kosak_2018_J.Med.Chem_61_119
PubMedID: 29227101
Gene_locus related to this paper: human-BCHE

Representative scheme of Prolylcarboxypeptidase structure and an image from PDBsum server


PDB-Sum : 5NN0 Previously Class, Architecture, Topology and Homologous superfamily - PDB-Sum server

FSSP : 5NN0 Fold classification based on Structure-Structure alignment of Proteins - FSSP server

SCOP : 5NN0 Structural Classification Of Protein - SCOP server

PROTEOPEDIA : 5NN0 3D, interactive encyclopedia of proteins - PROTEOPEDIA server