6TO7

Crystal structure of the Orexin-1 receptor in complex with suvorexant at 2.29 A resolution

6TO7 の概要

• エントリーDOI: 10.2210/pdb6to7/pdb
• 分子名称: Orexin receptor type 1, [(7R)-4-(5-chloro-1,3-benzoxazol-2-yl)-7-methyl-1,4-diazepan-1-yl][5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl]methanone, TETRAETHYLENE GLYCOL, ... (8 entities in total)
• 機能のキーワード: 7tm, gpcr, membrane protein
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 92943.23

構造登録者

Rappas, M.,Ali, A.,Bennett, K.A.,Brown, J.D.,Bucknell, S.J.,Congreve, M.,Cooke, R.M.,Cseke, G.,de Graaf, C.,Dore, A.S.,Errey, J.C.,Jazayeri, A.,Marshall, F.H.,Mason, J.S.,Mould, R.,Patel, J.C.,Tehan, B.G.,Weir, M.,Christopher, J.A. (登録日: 2019-12-11, 公開日: 2020-01-01, 最終更新日: 2024-01-24)

• 主引用文献: Rappas, M.,Ali, A.A.E.,Bennett, K.A.,Brown, J.D.,Bucknell, S.J.,Congreve, M.,Cooke, R.M.,Cseke, G.,de Graaf, C.,Dore, A.S.,Errey, J.C.,Jazayeri, A.,Marshall, F.H.,Mason, J.S.,Mould, R.,Patel, J.C.,Tehan, B.G.,Weir, M.,Christopher, J.A.; Comparison of Orexin 1 and Orexin 2 Ligand Binding Modes Using X-ray Crystallography and Computational Analysis.; J.Med.Chem., 63:1528-1543, 2020; PubMed: 31860301; DOI: 10.1021/acs.jmedchem.9b01787

実験手法

X-RAY DIFFRACTION (2.26 Å)