6W3K

Structure of unphosphorylated human IRE1 bound to G-9807

6W3K の概要

• エントリーDOI: 10.2210/pdb6w3k/pdb
• 分子名称: Serine/threonine-protein kinase/endoribonuclease IRE1, 4-[5-[2,6-bis(fluoranyl)phenyl]-2~{H}-pyrazolo[3,4-b]pyridin-3-yl]-2-(4-oxidanylpiperidin-1-yl)-1~{H}-pyrimidin-6-one (3 entities in total)
• 機能のキーワード: kinase, inhibitor, allosteric activator, upr, transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 49985.90

構造登録者

Lammens, A.,Wang, W.,Ferri, E.,Rudolph, J. (登録日: 2020-03-09, 公開日: 2020-12-09, 最終更新日: 2023-10-18)

• 主引用文献: Ferri, E.,Le Thomas, A.,Wallweber, H.A.,Day, E.S.,Walters, B.T.,Kaufman, S.E.,Braun, M.G.,Clark, K.R.,Beresini, M.H.,Mortara, K.,Chen, Y.A.,Canter, B.,Phung, W.,Liu, P.S.,Lammens, A.,Ashkenazi, A.,Rudolph, J.,Wang, W.; Activation of the IRE1 RNase through remodeling of the kinase front pocket by ATP-competitive ligands.; Nat Commun, 11:6387-6387, 2020; PubMed: 33318494; DOI: 10.1038/s41467-020-19974-5

実験手法

X-RAY DIFFRACTION (2.08 Å)