6KOT

Quadruple mutant (N51I+C59R+S108N+I164L) plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed with B12128 and NADPH

6KOT の概要

• エントリーDOI: 10.2210/pdb6kot/pdb
• 分子名称: Bifunctional dihydrofolate reductase-thymidylate synthase, 4-[3-[[2,6-bis(azanyl)-5-(3-chlorophenyl)pyrimidin-4-yl]methoxy]phenoxy]butanoic acid, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... (5 entities in total)
• 機能のキーワード: quadruple mutant dihydrofolate reductase, inhibitor, plasmodium falciparum, oxidoreductase, transferase
• 由来する生物種: Plasmodium falciparum (malaria parasite P. falciparum)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 146781.21

構造登録者

Vanichtanankul, J.,Vitsupakorn, D. (登録日: 2019-08-13, 公開日: 2019-12-04, 最終更新日: 2023-11-22)

• 主引用文献: Saepua, S.,Sadorn, K.,Vanichtanankul, J.,Anukunwithaya, T.,Rattanajak, R.,Vitsupakorn, D.,Kamchonwongpaisan, S.,Yuthavong, Y.,Thongpanchang, C.; 6-Hydrophobic aromatic substituent pyrimethamine analogues as potential antimalarials for pyrimethamine-resistant Plasmodium falciparum.; Bioorg.Med.Chem., 27:115158-115158, 2019; PubMed: 31685330; DOI: 10.1016/j.bmc.2019.115158

実験手法

X-RAY DIFFRACTION (2.149 Å)