3SX9

Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with Bumped Kinase Inhibitor, RM-1-132

Summary for 3SX9

Entry DOI	10.2210/pdb3sx9/pdb
Related	3I79 3I7B 3I7C 3MWU 3N51 3NCG 3NYV 3SXF 3T3U 3T3V
Descriptor	Calmodulin-domain protein kinase 1, 3-(6-ethoxynaphthalen-2-yl)-1-(piperidin-4-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine (3 entities in total)
Functional Keywords	serine/threonine protein kinase, transferase, calcium-binding, atp-binding, calmodulin, ef hand, bumped kinase inhibitor, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological source	Toxoplasma gondii
Total number of polymer chains	1
Total formula weight	55629.41
Authors	Larson, E.T.,Merritt, E.A. (deposition date: 2011-07-14, release date: 2012-03-14, Last modification date: 2023-09-13)
Primary citation	Larson, E.T.,Ojo, K.K.,Murphy, R.C.,Johnson, S.M.,Zhang, Z.,Kim, J.E.,Leibly, D.J.,Fox, A.M.,Reid, M.C.,Dale, E.J.,Perera, B.G.,Kim, J.,Hewitt, S.N.,Hol, W.G.,Verlinde, C.L.,Fan, E.,Van Voorhis, W.C.,Maly, D.J.,Merritt, E.A. Multiple determinants for selective inhibition of apicomplexan calcium-dependent protein kinase CDPK1. J.Med.Chem., 55:2803-2810, 2012 Cited by PubMed: 22369268 DOI: 10.1021/jm201725v PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.65 Å)

Structure validation