6VG0

CRYSTAL STRUCTURE OF HUMAN CYTOSOLIC ISOCITRATE DEHYDROGENASE (IDH1) R132H MUTANT IN COMPLEX WITH NADPH and AGI-15056

6VG0 の概要

• エントリーDOI: 10.2210/pdb6vg0/pdb
• 関連するPDBエントリー: 6VE1 6VFZ
• 分子名称: Isocitrate dehydrogenase [NADP] cytoplasmic, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, N~2~,N~4~-bis[(1R)-1-cyclopropylethyl]-6-[6-(trifluoromethyl)pyridin-2-yl]-1,3,5-triazine-2,4-diamine, ... (4 entities in total)
• 機能のキーワード: idh, cytosolic nadp-isocitrate dehydrogenase, oxalosuccinate decarboxylase, nadp(+)-specific icdh, idp, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 3
• 化学式量合計: 147428.16

構造登録者

Padyana, A.,Jin, L. (登録日: 2020-01-07, 公開日: 2020-02-05, 最終更新日: 2023-10-11)

• 主引用文献: Konteatis, Z.,Artin, E.,Nicolay, B.,Straley, K.,Padyana, A.K.,Jin, L.,Chen, Y.,Narayaraswamy, R.,Tong, S.,Wang, F.,Zhou, D.,Cui, D.,Cai, Z.,Luo, Z.,Fang, C.,Tang, H.,Lv, X.,Nagaraja, R.,Yang, H.,Su, S.M.,Sui, Z.,Dang, L.,Yen, K.,Popovici-Muller, J.,Codega, P.,Campos, C.,Mellinghoff, I.K.,Biller, S.A.; Vorasidenib (AG-881): A First-in-Class, Brain-Penetrant Dual Inhibitor of Mutant IDH1 and 2 for Treatment of Glioma.; Acs Med.Chem.Lett., 11:101-107, 2020; PubMed: 32071674; DOI: 10.1021/acsmedchemlett.9b00509

実験手法

X-RAY DIFFRACTION (2.66 Å)