5N2D

Structure of PD-L1/small-molecule inhibitor complex

5N2D の概要

• エントリーDOI: 10.2210/pdb5n2d/pdb
• 分子名称: Programmed cell death 1 ligand 1, ~{N}-[2-[[2,6-dimethoxy-4-[(2-methyl-3-phenyl-phenyl)methoxy]phenyl]methylamino]ethyl]ethanamide (3 entities in total)
• 機能のキーワード: pd-l1, pd-1, small-molecule inhibitor, cell cycle
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Isoform 1: Cell membrane ; Single-pass type I membrane protein . Isoform 2: Endomembrane system ; Single-pass type I membrane protein : Q9NZQ7
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 67834.12

構造登録者

Guzik, K.,Zak, K.M.,Grudnik, P.,Dubin, G.,Holak, T.A. (登録日: 2017-02-07, 公開日: 2017-06-28, 最終更新日: 2024-01-17)

• 主引用文献: Guzik, K.,Zak, K.M.,Grudnik, P.,Magiera, K.,Musielak, B.,Torner, R.,Skalniak, L.,Domling, A.,Dubin, G.,Holak, T.A.; Small-Molecule Inhibitors of the Programmed Cell Death-1/Programmed Death-Ligand 1 (PD-1/PD-L1) Interaction via Transiently Induced Protein States and Dimerization of PD-L1.; J. Med. Chem., 60:5857-5867, 2017; PubMed: 28613862; DOI: 10.1021/acs.jmedchem.7b00293

実験手法

X-RAY DIFFRACTION (2.35 Å)