6BO7

Crystal structure of Plasmodium vivax hypoxanthine guanine phosphoribosyltransferase in complex with [3R,4R]-4-guanin-9-yl-3-((S)-2-hydroxy-2-phosphonoethyl)oxy-1-N-(phosphonopropionyl)pyrrolidine

Replaces:  5HHU

Summary for 6BO7

• Entry DOI: 10.2210/pdb6bo7/pdb
• Descriptor: Hypoxanthine phosphoribosyltransferase, MAGNESIUM ION, [3-[(3~{R},4~{R})-3-(2-azanyl-6-oxidanylidene-1~{H}-purin-9-yl)-4-[(2~{S})-2-oxidanyl-2-phosphono-ethoxy]pyrrolidin-1-y l]-3-oxidanylidene-propyl]phosphonic acid (3 entities in total)
• Functional Keywords: inhibitor, complex, phosphonate, phosphoribosyltransferase, transferase, transferase-inhibitor complex, transferase/inhibitor
• Biological source: Plasmodium vivax (malaria parasite P. vivax)
• Total number of polymer chains: 12
• Total formula weight: 339094.01

Authors

Guddat, L.W.,Keough, D.T.,Rejman, D. (deposition date: 2017-11-18, release date: 2017-12-13, Last modification date: 2024-03-13)

• Primary citation: Keough, D.T.,Rejman, D.,Pohl, R.,Zbornikova, E.,Hockova, D.,Croll, T.,Edstein, M.D.,Birrell, G.W.,Chavchich, M.,Naesens, L.M.J.,Pierens, G.K.,Brereton, I.M.,Guddat, L.W.; Design of Plasmodium vivax Hypoxanthine-Guanine Phosphoribosyltransferase Inhibitors as Potential Antimalarial Therapeutics.; ACS Chem. Biol., 13:82-90, 2018; PubMed: 29161011; DOI: 10.1021/acschembio.7b00916

Experimental method

X-RAY DIFFRACTION (2.856 Å)