8CU6

Crystal structure of A2AAR-StaR2-S277-bRIL in complex with a novel A2a antagonist, LJ-4517

8CU6 の概要

• エントリーDOI: 10.2210/pdb8cu6/pdb
• 分子名称: Adenosine receptor A2a,Soluble cytochrome b562, OLEIC ACID, (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, ... (7 entities in total)
• 機能のキーワード: gpcr, a2a adenosine receptor, lcp, nucleoside, antagonist, molecular dynamics, membrane protein
• 由来する生物種: Homo sapiens (human); 詳細
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 56941.43

構造登録者

Shiriaeva, A.,Park, D.-J.,Kim, G.,Lee, Y.,Hou, X.,Jarhad, D.B.,Kim, G.,Yu, J.,Hyun, Y.E.,Kim, W.,Gao, Z.-G.,Jacobson, K.A.,Han, G.W.,Stevens, R.C.,Jeong, L.S.,Choi, S.,Cherezov, V. (登録日: 2022-05-16, 公開日: 2022-08-31, 最終更新日: 2023-10-18)

• 主引用文献: Shiriaeva, A.,Park, D.,Kim, G.,Lee, Y.,Hou, X.,Jarhad, D.B.,Kim, G.,Yu, J.,Hyun, Y.E.,Kim, W.,Gao, Z.G.,Jacobson, K.A.,Han, G.W.,Stevens, R.C.,Jeong, L.S.,Choi, S.,Cherezov, V.; GPCR Agonist-to-Antagonist Conversion: Enabling the Design of Nucleoside Functional Switches for the A 2A Adenosine Receptor.; J.Med.Chem., 65:11648-11657, 2022; PubMed: 35977382; DOI: 10.1021/acs.jmedchem.2c00462

実験手法

X-RAY DIFFRACTION (2.8 Å)