5AX3

Crystal structure of ERK2 complexed with allosteric and ATP-competitive inhibitors.

5AX3 の概要

• エントリーDOI: 10.2210/pdb5ax3/pdb
• 分子名称: Mitogen-activated protein kinase 1, allosteric and ATP-competitive inhibitor, (2R,3R,4S,5R)-2-(4-AMINO-5-IODO-7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-5-(HYDROXYMETHYL)TETRAHYDROFURAN-3,4-DIOL (3 entities in total)
• 機能のキーワード: ternary complex, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (Human); 詳細
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 44115.40

構造登録者

Kinoshita, T.,Sugiyama, H.,Mori, Y.,Takahashi, N.,Tomonaga, A. (登録日: 2015-07-14, 公開日: 2016-02-10, 最終更新日: 2023-11-08)

• 主引用文献: Kinoshita, T.,Sugiyama, H.,Mori, Y.,Takahashi, N.,Tomonaga, A.; Identification of allosteric ERK2 inhibitors through in silico biased screening and competitive binding assay; Bioorg.Med.Chem.Lett., 26:955-958, 2016; PubMed: 26733474; DOI: 10.1016/j.bmcl.2015.12.056

実験手法

X-RAY DIFFRACTION (2.984 Å)