Brand  (β version)

PDB ID: 6F7Q

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Ligands
Code Name Style Show Link
CL Chloride ion PoSSuM
CWQ 2-[[(3~{R})-1-(2,3-dihydro-1~{H}-inden-2-yl)piperidin-3-yl]methyl-(8-oxidanylquinolin-2-yl)carbonyl-amino]ethyl-dimethyl-azanium PoSSuM
EDO 1,2-ethanediol PoSSuM
GOL Glycerol PoSSuM
SO4 Sulfate ion PoSSuM
Non-standard Residues
Code Name Show
Glycosylation
Code Name Emphasize
FUC Alpha-L-fucopyranose
FUL Beta-L-fucopyranose
NAG 2-acetamido-2-deoxy-beta-D-glucopyranose
Modification
Code Name Show

Structure summary

Code : 6F7Q   PDBj   RCSB PDB   PDBe
Header : HYDROLASE
Title : Human Butyrylcholinesterase complexed with N-Propargyliperidines
Release Data : 2018-09-05
Compound :
mol_id molecule chains synonym
1 Cholinesterase A,B Acylcholine acylhydrolase,Butyrylcholine esterase,Choline esterase II,Pseudocholinesterase
ec: 3.1.1.8
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Cricetulus griseus  (taxid:10029)
gene: BCHE, CHE1
Authors : Coquelle, N., Knez, D., Colletier, J.P., Gobec, S.
Keywords : Alzheimer disease AD butyrylcholinesterase N-Propargyliperidines, hydrolase
Exp. method : X-RAY DIFFRACTION ( 2.600 Å )
Citation :

Multi-target-directed ligands for treating Alzheimer's disease: Butyrylcholinesterase inhibitors displaying antioxidant and neuroprotective activities.

Knez, D.,Coquelle, N.,Pislar, A.  et al.
(2018)  Eur.J.Med.Chem.  156 : 598 - 617

PubMed: 30031971
DOI: 10.1016/j.ejmech.2018.07.033

Reaction

Chain : A, B
UniProt : P06276 (CHLE_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
an acylcholine + H2O = a carboxylate + choline + H(+) 3.1.1.8 PubMed:19368529, PubMed:19452557
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