6I3S

Crystal structure of MDM2 in complex with compound 13.

6I3S の概要

• エントリーDOI: 10.2210/pdb6i3s/pdb
• 分子名称: E3 ubiquitin-protein ligase Mdm2, (3~{S},3'~{R},3'~{a}~{S},6'~{a}~{R})-6-chloranyl-3'-(3-chloranyl-2-fluoranyl-phenyl)-1'-(cyclopropylmethyl)spiro[1~{H}-indole-3,2'-3~{a},6~{a}-dihydro-3~{H}-pyrrolo[3,4-b]pyrrole]-2,4'-dione, GLYCEROL, ... (5 entities in total)
• 機能のキーワード: inhibitor, ligase
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 11754.45

構造登録者

Bader, G.,Kessler, D. (登録日: 2018-11-07, 公開日: 2018-12-19, 最終更新日: 2024-05-15)

• 主引用文献: Gollner, A.,Weinstabl, H.,Fuchs, J.E.,Rudolph, D.,Garavel, G.,Hofbauer, K.S.,Karolyi-Oezguer, J.,Gmaschitz, G.,Hela, W.,Kerres, N.,Grondal, E.,Werni, P.,Ramharter, J.,Broeker, J.,McConnell, D.B.; Targeted Synthesis of Complex Spiro[3H-indole-3,2'-pyrrolidin]-2(1H)-ones by Intramolecular Cyclization of Azomethine Ylides: Highly Potent MDM2-p53 Inhibitors.; ChemMedChem, 14:88-93, 2019; PubMed: 30458062; DOI: 10.1002/cmdc.201800617

実験手法

X-RAY DIFFRACTION (1.77 Å)