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7G4H

Crystal Structure of rat Autotaxin in complex with [2-methyl-4-(trifluoromethoxy)phenyl]methyl 2-(1,4,6,7-tetrahydrotriazolo[4,5-c]pyridine-5-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate, i.e. SMILES N1(CCN2C(=CC(=N2)C(=O)N2CCC3=C(C2)N=NN3)C1)C(=O)OCc1c(cc(cc1)OC(F)(F)F)C with IC50=0.268343 microM

7G4H の概要
エントリーDOI10.2210/pdb7g4h/pdb
Group depositionTo be published (G_1002267)
分子名称Isoform 2 of Ectonucleotide pyrophosphatase/phosphodiesterase family member 2, alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-alpha-D-mannopyranose-(1-6)-[alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, [2-methyl-4-(trifluoromethoxy)phenyl]methyl (8R)-2-(1,4,6,7-tetrahydro-5H-[1,2,3]triazolo[4,5-c]pyridine-5-carbonyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-5(4H)-carboxylate, ... (10 entities in total)
機能のキーワードhydrolase, lysophosphatidic acid, lpa, lysophosphatidylcholine, lpc, somatomedin, metastasis, neuropathic pain, vascular development, neural development
由来する生物種Rattus norvegicus (Norway rat)
タンパク質・核酸の鎖数1
化学式量合計99666.24
構造登録者
Stihle, M.,Benz, J.,Hunziker, D.,Rudolph, M.G. (登録日: 2023-06-05, 公開日: 2024-12-18)
主引用文献Hunziker, D.,Joachim, S.C.,Ullmer, C.,Rudolph, M.G.
Crystal Structure of a rat Autotaxin complex
To be published,
実験手法
X-RAY DIFFRACTION (2.06 Å)
構造検証レポート
Validation report summary of 7g4h
検証レポート(詳細版)ダウンロードをダウンロード

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件を2025-07-30に公開中

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