5LAW

Novel Spiro[3H-indole-3,2 -pyrrolidin]-2(1H)-one Inhibitors of the MDM2-p53 Interaction: HDM2 (MDM2) IN COMPLEX WITH COMPOUND 14

5LAW の概要

• エントリーDOI: 10.2210/pdb5law/pdb
• 分子名称: E3 ubiquitin-protein ligase Mdm2, 2-[(3~{S},3'~{a}~{S},6'~{S},6'~{a}~{S})-6-chloranyl-6'-(3-chlorophenyl)-4'-(cyclopropylmethyl)-2-oxidanylidene-spiro[1~{H}-indole-3,5'-3,3~{a},6,6~{a}-tetrahydro-2~{H}-pyrrolo[3,2-b]pyrrole]-1'-yl]ethanoic acid, SULFATE ION, ... (4 entities in total)
• 機能のキーワード: vienna, ppi, mdm2, hdm2, bi, 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: 11786.50

構造登録者

Kessler, D.,Gollner, A. (登録日: 2016-06-15, 公開日: 2016-11-02, 最終更新日: 2024-05-08)

• 主引用文献: Gollner, A.,Rudolph, D.,Arnhof, H.,Bauer, M.,Blake, S.M.,Boehmelt, G.,Cockroft, X.L.,Dahmann, G.,Ettmayer, P.,Gerstberger, T.,Karolyi-Oezguer, J.,Kessler, D.,Kofink, C.,Ramharter, J.,Rinnenthal, J.,Savchenko, A.,Schnitzer, R.,Weinstabl, H.,Weyer-Czernilofsky, U.,Wunberg, T.,McConnell, D.B.; Discovery of Novel Spiro[3H-indole-3,2'-pyrrolidin]-2(1H)-one Compounds as Chemically Stable and Orally Active Inhibitors of the MDM2-p53 Interaction.; J. Med. Chem., 59:10147-10162, 2016; PubMed: 27775892; DOI: 10.1021/acs.jmedchem.6b00900

実験手法

X-RAY DIFFRACTION (1.64 Å)