Brand  (β version)

PDB ID: 6G4P

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Ligands
Code Name Style Show Link
CL Chloride ion PoSSuM
ELT Ethoxy-~{N},~{N}-dimethyl-phosphonamidic acid PoSSuM
JDS 6-[4-[(7-chloranyl-1,2,3,4-tetrahydroacridin-9-yl)amino]butyl]-2-[(~{z})-hydroxyiminomethyl]pyridin-3-ol PoSSuM
PG4 Tetraethylene glycol PoSSuM
Non-standard Residues
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Glycosylation
Code Name Emphasize
NAG 2-acetamido-2-deoxy-beta-D-glucopyranose
Modification
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Structure summary

Code : 6G4P   PDBj   RCSB PDB   PDBe
Header : HYDROLASE
Title : Non-aged form of Torpedo californica acetylcholinesterase inhibited by tabun analog NEDPA bound to uncharged reactivator 2
Release Data : 2018-08-29
Compound :
mol_id molecule chains synonym
1 Acetylcholinesterase A,B AChE
ec: 3.1.1.7
Source :
mol_id organism_scientific organism_common
1 Tetronarce californica  (taxid:7787) Pacific electric ray
Authors : Santoni, G., De la Mora, E., de Souza, J., Silman, I., Sussman, J., Baati, R., Weik, M., Nachon, F.
Keywords : acetylcholinesterase, tabun, nerve agent, HYDROLASE
Exp. method : X-RAY DIFFRACTION ( 2.830 Å )
Citation :

Structure-Based Optimization of Nonquaternary Reactivators of Acetylcholinesterase Inhibited by Organophosphorus Nerve Agents.

Santoni, G.,de Sousa, J.,de la Mora, E.  et al.
(2018)  J. Med. Chem.  61 : 7630 - 7639

PubMed: 30125110
DOI: 10.1021/acs.jmedchem.8b00592

Reaction

Chain : A, B
UniProt : P04058 (ACES_TETCF)
Reaction: EC: Evidence:
Physiological Direction:
acetylcholine + H2O = acetate + choline + H(+) 3.1.1.7 -
-