1BOZ

STRUCTURE-BASED DESIGN AND SYNTHESIS OF LIPOPHILIC 2,4-DIAMINO-6-SUBSTITUTED QUINAZOLINES AND THEIR EVALUATION AS INHIBITORS OF DIHYDROFOLATE REDUCTASE AND POTENTIAL ANTITUMOR AGENTS

1BOZ の概要

• エントリーDOI: 10.2210/pdb1boz/pdb
• 分子名称: PROTEIN (DIHYDROFOLATE REDUCTASE), NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, N6-(2,5-DIMETHOXY-BENZYL)-N6-METHYL-PYRIDO[2,3-D]PYRIMIDINE-2,4,6-TRIAMINE, ... (4 entities in total)
• 機能のキーワード: oxidoreductase
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Mitochondrion : P00374
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 22345.20

構造登録者

Gangjee, A.,Vidwans, A.P.,Vasudevan, A.,Queener, S.F.,Kisliuk, R.L.,Cody, V.,Li, R.,Galitsky, N.,Luft, J.R.,Pangborn, W. (登録日: 1998-08-06, 公開日: 1998-08-12, 最終更新日: 2022-12-21)

• 主引用文献: Gangjee, A.,Vidwans, A.P.,Vasudevan, A.,Queener, S.F.,Kisliuk, R.L.,Cody, V.,Li, R.,Galitsky, N.,Luft, J.R.,Pangborn, W.; Structure-based design and synthesis of lipophilic 2,4-diamino-6-substituted quinazolines and their evaluation as inhibitors of dihydrofolate reductases and potential antitumor agents.; J.Med.Chem., 41:3426-3434, 1998; PubMed: 9719595; DOI: 10.1021/jm980081y

実験手法

X-RAY DIFFRACTION (2.1 Å)