5VO6

CRYSTAL STRUCTURE OF JAK3 KINASE DOMAIN IN COMPLEX WITH A PYRROLOPYRIDAZINE INHIBITOR

5VO6 の概要

• エントリーDOI: 10.2210/pdb5vo6/pdb
• 分子名称: Tyrosine-protein kinase JAK3, 4-{[(1R,3S)-3-amino-2,2,3-trimethylcyclopentyl]amino}-6-phenylpyrrolo[1,2-b]pyridazine-3-carboxamide (3 entities in total)
• 機能のキーワード: transferase, transferase-inhibitor complex, transferase/inhibitor
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Endomembrane system ; Peripheral membrane protein : P52333
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 33631.50

構造登録者

Sack, J.S. (登録日: 2017-05-02, 公開日: 2017-05-31, 最終更新日: 2024-03-13)

• 主引用文献: Hynes, J.,Wu, H.,Kempson, J.,Duan, J.J.,Lu, Z.,Jiang, B.,Stachura, S.,Tokarski, J.S.,Sack, J.S.,Khan, J.A.,Lippy, J.S.,Zhang, R.F.,Pitt, S.,Shen, G.,Gillooly, K.,McIntyre, K.,Carter, P.H.,Barrish, J.C.,Nadler, S.G.,Salter-Cid, L.M.,Fura, A.,Schieven, G.L.,Pitts, W.J.,Wrobleski, S.T.; Discovery of potent and efficacious pyrrolopyridazines as dual JAK1/3 inhibitors.; Bioorg. Med. Chem. Lett., 27:3101-3106, 2017; PubMed: 28539220; DOI: 10.1016/j.bmcl.2017.05.043

実験手法

X-RAY DIFFRACTION (2.65 Å)