7AIV
Crystal structure of Torpedo Californica acetylcholinesterase in complex with 4-{[(3-Chloro-6,7,10,11-tetrahydro-9-methyl-7,11-methanocycloocta[b]quinolin-12-yl)amino]methyl}-N-(4-hydroxy-3-methoxybenzyl)benzamide
Summary for 7AIV
Entry DOI | 10.2210/pdb7aiv/pdb |
Descriptor | Acetylcholinesterase, 4-{[(3-Chloro-6,7,10,11-tetrahydro-9-methyl-7,11-methanocycloocta[b]quinolin-12-yl)amino]methyl}-N-(4-hydroxy-3-methoxybenzyl)benzamide (3 entities in total) |
Functional Keywords | torpedo californica acetylcholinesterase, ad, alzheimer disease, hydrolase |
Biological source | Tetronarce californica (Pacific electric ray) |
Total number of polymer chains | 2 |
Total formula weight | 132509.53 |
Authors | Coquelle, N.,Colletier, J.P. (deposition date: 2020-09-28, release date: 2021-10-06, Last modification date: 2024-01-31) |
Primary citation | Viayna, E.,Coquelle, N.,Cieslikiewicz-Bouet, M.,Cisternas, P.,Oliva, C.A.,Sanchez-Lopez, E.,Ettcheto, M.,Bartolini, M.,De Simone, A.,Ricchini, M.,Rendina, M.,Pons, M.,Firuzi, O.,Perez, B.,Saso, L.,Andrisano, V.,Nachon, F.,Brazzolotto, X.,Garcia, M.L.,Camins, A.,Silman, I.,Jean, L.,Inestrosa, N.C.,Colletier, J.P.,Renard, P.Y.,Munoz-Torrero, D. Discovery of a Potent Dual Inhibitor of Acetylcholinesterase and Butyrylcholinesterase with Antioxidant Activity that Alleviates Alzheimer-like Pathology in Old APP/PS1 Mice. J.Med.Chem., 64:812-839, 2021 Cited by PubMed: 33356266DOI: 10.1021/acs.jmedchem.0c01775 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.55 Å) |
Structure validation
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