7TUX

Crystal Structure of Plasmodium falciparum Hypoxanthine-Guanine-Xanthine Phosphoribosyltransferase in complex with [(3S)-4-Hydroxy-3-[({2-amino-4-hydroxy-5H-pyrrolo[3,2-d]pyrimidin-7-yl}methyl)amino]butyl]phosphonic acid

Summary for 7TUX

• Entry DOI: 10.2210/pdb7tux/pdb
• Descriptor: Hypoxanthine-guanine-xanthine phosphoribosyltransferase, [(3S)-3-{[(2-amino-4-hydroxy-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]amino}-4-hydroxybutyl]phosphonic acid, PYROPHOSPHATE 2-, ... (7 entities in total)
• Functional Keywords: inhibitors, drug design, transferase-inhibitor complex, malaria, transition state analogs, transferase, plasmodium falciparum, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Plasmodium falciparum (malaria parasite P. falciparum)
• Total number of polymer chains: 4
• Total formula weight: 118363.66

Authors

Harijan, R.K.,Minnow, Y.V.T.,Bonanno, J.B.,Almo, S.C.,Schramm, V.L. (deposition date: 2022-02-03, release date: 2022-12-07, Last modification date: 2023-10-25)

• Primary citation: V T Minnow, Y.,Suthagar, K.,Clinch, K.,Ducati, R.G.,Ghosh, A.,Buckler, J.N.,Harijan, R.K.,Cahill, S.M.,Tyler, P.C.,Schramm, V.L.; Inhibition and Mechanism of Plasmodium falciparum Hypoxanthine-Guanine-Xanthine Phosphoribosyltransferase.; Acs Chem.Biol., 17:3407-3419, 2022; PubMed: 36413975; DOI: 10.1021/acschembio.2c00546

Experimental method

X-RAY DIFFRACTION (1.62 Å)