4KP7

Structure of Plasmodium IspC in complex with a beta-thia-isostere derivative of Fosmidomycin

Summary for 4KP7

Entry DOI	10.2210/pdb4kp7/pdb
Related	3AU8 3AU9
Descriptor	1-deoxy-D-xylulose 5-phosphate reductoisomerase, apicoplast, MANGANESE (III) ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... (5 entities in total)
Functional Keywords	dxp pathway, drug optimization, non-covalent inhibition, malaria, tuberculosis, rossmann fold, reductoisomerase, nadph binding, apicoplast, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
Biological source	Plasmodium falciparum
Cellular location	Plastid, apicoplast: O96693
Total number of polymer chains	2
Total formula weight	98739.81
Authors	Kunfermann, A.,Bacher, A.,Groll, M. (deposition date: 2013-05-13, release date: 2013-10-02, Last modification date: 2023-09-20)
Primary citation	Kunfermann, A.,Lienau, C.,Illarionov, B.,Held, J.,Grawert, T.,Behrendt, C.T.,Werner, P.,Hahn, S.,Eisenreich, W.,Riederer, U.,Mordmuller, B.,Bacher, A.,Fischer, M.,Groll, M.,Kurz, T. IspC as Target for Antiinfective Drug Discovery: Synthesis, Enantiomeric Separation, and Structural Biology of Fosmidomycin Thia Isosters. J.Med.Chem., 56:8151-8162, 2013 Cited by PubMed: 24032981 DOI: 10.1021/jm4012559 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2 Å)

Structure validation