3GMD

Structure-based design of 7-Azaindole-pyrrolidines as inhibitors of 11beta-Hydroxysteroid-Dehydrogenase type I

3GMD の概要

• エントリーDOI: 10.2210/pdb3gmd/pdb
• 分子名称: Corticosteroid 11-beta-dehydrogenase isozyme 1, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 2-methyl-3-{(3S)-1-[(1-pyridin-2-ylcyclopropyl)carbonyl]pyrrolidin-3-yl}-1H-pyrrolo[2,3-b]pyridine, ... (5 entities in total)
• 機能のキーワード: alpha/beta, endoplasmic reticulum, glycoprotein, lipid metabolism, membrane, nadp, oxidoreductase, signal-anchor, steroid metabolism, transmembrane, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• 由来する生物種: Mus musculus (mouse)
• 細胞内の位置: Endoplasmic reticulum membrane; Single-pass type II membrane protein: P50172
• タンパク質・核酸の鎖数: 8
• 化学式量合計: 241478.85

構造登録者

Valeur, E.,Lepifre, F.,Roche, D.,Christmann-Franck, S.,Hillertz, P.,Musil, D. (登録日: 2009-03-13, 公開日: 2010-11-17, 最終更新日: 2024-02-21)

• 主引用文献: Valeur, E.,Christmann-Franck, S.,Lepifre, F.,Carniato, D.,Cravo, D.,Charon, C.,Bozec, S.,Musil, D.,Hillertz, P.,Doare, L.,Schmidlin, F.,Lecomte, M.,Schultz, M.,Roche, D.; Structure-based design of 7-azaindole-pyrrolidine amides as inhibitors of 11 beta-hydroxysteroid dehydrogenase type I.; Bioorg.Med.Chem.Lett., 22:5909-5914, 2012; PubMed: 22901389; DOI: 10.1016/j.bmcl.2012.07.070

実験手法

X-RAY DIFFRACTION (2.28 Å)