Het-PDB Navi2 (PDB: 3V5P)

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Ligands
Code	Name		Style	Show	Link
C88	3-(4-methoxy-3-methylphenyl)-1-(piperidin-4-ylmethyl)-1h-pyrazolo[3,4-D]pyrimidin-4-amine				PoSSuM

Non-standard Residues
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Download interaction data: 3V5P

Code :

3V5P PDBj RCSB PDB PDBe

Header :

TRANSFERASE/TRANSFERASE INHIBITOR

Title :

Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with inhibitor UW1288

Release Data :

2012-03-14

Compound :

mol_id	molecule	chains	synonym
1	Calmodulin-domain protein kinase 1	A	Calmodulin-domain protein kinase, putative
	ec: 2.7.11.17 fragment: UNP residues 30-507

Source :

mol_id	organism_scientific	expression_system
1	Toxoplasma gondii (taxid:5811)	Escherichia coli (taxid:562)
	gene: AAG53993, CDPK1, TGGT1_059880, TGVEG_042030 expression_system_strain: BL21(DE3) expression_system_vector_type: plasmid expression_system_plasmid: AVA0421

Authors :

Merritt, E.A., Larson, E.T.

Keywords :

serine/threonine protein kinase, calcium-binding, ATP-binding, bumped kinase inhibitor, TRANSFERASE-TRANSFERASE INHIBITOR complex

Exp. method :

X-RAY DIFFRACTION ( 2.1000 Å )

Citation :

Multiple Determinants for Selective Inhibition of Apicomplexan Calcium-Dependent Protein Kinase CDPK1.

Larson, E.T.,Ojo, K.K.,Murphy, R.C. et al.
(2012) J.Med.Chem. 55 : 2803 - 2810

Toxoplasma gondii calcium-dependent protein kinase 1 is a target for selective kinase inhibitors

Ojo, K.K.,Larson, E.T.,Keyloun, K.R. et al.
(2010) Nat.Struct.Mol.Biol. 17 : 602 - 607

Discovery of potent and selective inhibitors of Calcium-Dependent Protein Kinase 1 (CDPK1) from C. parvum and T. gondii

Murphy, R.C.,Ojo, K.K.,Larson, E.T. et al.
(2010) ACS Med.Chem.Lett. 1 : 331 - 335

PDB ID: 3V5P