8COY

Structure of the catalytic domain of P. vivax Sub1 (triclinic crystal form) in complex with inhibitor

Summary for 8COY

Entry DOI	10.2210/pdb8coy/pdb
Descriptor	subtilisin, peptido-mimetic inhibitor, 2-acetamido-2-deoxy-beta-D-glucopyranose, ... (6 entities in total)
Functional Keywords	plasmodium, serine protease, drug target, malaria, pseudo-peptide inhibitor, hydrolase
Biological source	Plasmodium vivax (malaria parasite P. vivax) More
Total number of polymer chains	4
Total formula weight	78264.11
Authors	Martinez, M.,Bouillon, A.,Batista, F.,Alzari, P.M.,Barale, J.C.,Haouz, A. (deposition date: 2023-03-01, release date: 2023-07-19, Last modification date: 2023-11-22)
Primary citation	Martinez, M.,Batista, F.A.,Maurel, M.,Bouillon, A.,Ortega Varga, L.,Wehenkel, A.M.,Le Chevalier-Sontag, L.,Blondel, A.,Haouz, A.,Hernandez, J.F.,Alzari, P.M.,Barale, J.C. 3D structures of the Plasmodium vivax subtilisin-like drug target SUB1 reveal conformational changes to accommodate a substrate-derived alpha-ketoamide inhibitor. Acta Crystallogr D Struct Biol, 79:721-734, 2023 Cited by PubMed: 37428845 DOI: 10.1107/S2059798323004710 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.507 Å)

Structure validation