1B0F

CRYSTAL STRUCTURE OF HUMAN NEUTROPHIL ELASTASE WITH MDL 101, 146

1B0F の概要

• エントリーDOI: 10.2210/pdb1b0f/pdb
• 分子名称: PROTEIN (ELASTASE), 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, 1-{3-METHYL-2-[4-(MORPHOLINE-4-CARBONYL)-BENZOYLAMINO]-BUTYRYL}-PYRROLIDINE-2-CARBOXYLIC ACID (3,3,4,4,4-PENTAFLUORO-1-ISOPROPYL-2-OXO-BUTYL)-AMIDE, ... (4 entities in total)
• 機能のキーワード: serine protease, fluoroethyl ketones, hydrolase
• 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: 25007.55

構造登録者

Schreuder, H.A.,Metz, W.A.,Peet, N.P.,Pelton, J.T.,Tardif, C. (登録日: 1998-11-09, 公開日: 1998-11-09, 最終更新日: 2023-08-09)

• 主引用文献: Cregge, R.J.,Durham, S.L.,Farr, R.A.,Gallion, S.L.,Hare, C.M.,Hoffman, R.V.,Janusz, M.J.,Kim, H.O.,Koehl, J.R.,Mehdi, S.,Metz, W.A.,Peet, N.P.,Pelton, J.T.,Schreuder, H.A.,Sunder, S.,Tardif, C.; Inhibition of human neutrophil elastase. 4. Design, synthesis, X-ray crystallographic analysis, and structure-activity relationships for a series of P2-modified, orally active peptidyl pentafluoroethyl ketones.; J.Med.Chem., 41:2461-2480, 1998; PubMed: 9651152; DOI: 10.1021/jm970812e

実験手法

X-RAY DIFFRACTION (3 Å)