6SBQ

The crystal structure of PfA-M1 in complex with 7-amino-4-phenyl-5,7,8,9-tetrahydrobenzocyclohepten-6-one

Summary for 6SBQ

Entry DOI	10.2210/pdb6sbq/pdb
Descriptor	M1-family alanyl aminopeptidase, ZINC ION, [(7~{S})-6,6-bis(oxidanyl)-4-phenyl-5,7,8,9-tetrahydrobenzo[7]annulen-7-yl]azanium, ... (7 entities in total)
Functional Keywords	m1 aminopeptidase, hydrolase
Biological source	Plasmodium falciparum (isolate 3D7)
Total number of polymer chains	1
Total formula weight	108415.83
Authors	Salomon, E.,Schmitt, M.,Mouray, E.,McEwen, A.G.,Torchy, M.,Poussin-Courmontagne, P.,Alavi, S.,Tarnus, C.,Cavarelli, J.,Florent, I.,Albrecht, S. (deposition date: 2019-07-22, release date: 2020-03-25, Last modification date: 2024-01-24)
Primary citation	Salomon, E.,Schmitt, M.,Mouray, E.,McEwen, A.G.,Bounaadja, L.,Torchy, M.,Poussin-Courmontagne, P.,Alavi, S.,Tarnus, C.,Cavarelli, J.,Florent, I.,Albrecht, S. Aminobenzosuberone derivatives as PfA-M1 inhibitors: Molecular recognition and antiplasmodial evaluation. Bioorg.Chem., 98:103750-103750, 2020 Cited by PubMed: 32182520 DOI: 10.1016/j.bioorg.2020.103750 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.33 Å)

Structure validation