2WQB

Structure of the Tie2 kinase domain in complex with a thiazolopyrimidine inhibitor

2WQB の概要

• エントリーDOI: 10.2210/pdb2wqb/pdb
• 関連するPDBエントリー: 1FVR 2GY5
• 分子名称: ANGIOPOIETIN-1 RECEPTOR, 2-[3-(CYCLOHEXYLMETHYL)-5-PHENYL-IMIDAZOL-4-YL]-[1,3]THIAZOLO[4,5-E]PYRIMIDIN-7-AMINE (3 entities in total)
• 機能のキーワード: phosphoprotein, kinase, receptor, oncology, atp-binding, transferase, glycoprotein, tyrosine-protein kinase, phosphotransferase, nucleotide-binding, disease mutation, thiazolopyrimidine
• 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: 37383.74

構造登録者

Brassington, C.,Breed, J.,Buttar, D.,Fitzek, M.,Forder, C.,Hassall, L.,Hayter, B.R.,Jones, C.D.,Luke, R.W.A.,McCall, E.,McCoull, W.,Norman, R.,Paterson, D.,McMiken, H.,Rowsell, S.,Tucker, J.A. (登録日: 2009-08-18, 公開日: 2009-11-03, 最終更新日: 2024-11-13)

主引用文献

Luke, R.W.,Ballard, P.,Buttar, D.,Campbell, L.,Curwen, J.,Emery, S.C.,Griffen, A.M.,Hassall, L.,Hayter, B.R.,Jones, C.D.,Mccoull, W.,Mellor, M.,Swain, M.L.,Tucker, J.A.
Novel Thienopyrimidine and Thiazolopyrimidine Kinase Inhibitors with Activity Against Tie-2 in Vitro and in Vivo.
Bioorg.Med.Chem.Lett., 19:6670-, 2009

PubMed Abstract: The SAR and improvement in potency against Tie2 of novel thienopyrimidine and thiazolopyrimidine kinase inhibitors are reported. The crystal structure of one of these compounds bound to the Tie-2 kinase domain is consistent with the SAR. These compounds have moderate potency in cellular assays of Tie-2 inhibition, good physical properties, DMPK, and show evidence of in vivo inhibition of Tie-2.

PubMed: 19854647
DOI: 10.1016/J.BMCL.2009.10.001

実験手法

X-RAY DIFFRACTION (2.95 Å)