タイトル | Hydrazones and Thiosemicarbazones Targeting Protein-Protein-Interactions of SARS-CoV-2 Papain-like Protease. |
---|
ジャーナル・号・ページ | Front Chem, Vol. 10, Page 832431-832431, Year 2022 |
---|
掲載日 | 2021年11月23日 (構造データの登録日) |
---|
著者 | Ewert, W. / Gunther, S. / Miglioli, F. / Falke, S. / Reinke, P.Y.A. / Niebling, S. / Gunther, C. / Han, H. / Srinivasan, V. / Brognaro, H. ...Ewert, W. / Gunther, S. / Miglioli, F. / Falke, S. / Reinke, P.Y.A. / Niebling, S. / Gunther, C. / Han, H. / Srinivasan, V. / Brognaro, H. / Lieske, J. / Lorenzen, K. / Garcia-Alai, M.M. / Betzel, C. / Carcelli, M. / Hinrichs, W. / Rogolino, D. / Meents, A. |
---|
リンク | Front Chem / PubMed:35480391 |
---|
手法 | X線回折 |
---|
解像度 | 1.75 - 1.92 Å |
---|
構造データ | PDB-7qcg: Structure of SARS-CoV-2 Papain-like Protease bound to N-(2-pyrrolidyl)-3,4,5-trihydroxybenzoylhydrazone 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-7qch: Structure of SARS-CoV-2 Papain-like Protease bound to N-(3,5-dimethoxy-4-hydroxybenzyliden)thiosemicarbazone 手法: X-RAY DIFFRACTION / 解像度: 1.88 Å PDB-7qci: Structure of SARS-CoV-2 Papain-like Protease bound to N-(3,4-dihydroxybenzylidene)-thiosemicarbazone 手法: X-RAY DIFFRACTION / 解像度: 1.76 Å PDB-7qcj: Structure of SARS-CoV-2 Papain-like Protease bound to N-(2,4-dihydroxybenzylidene)-thiosemicarbazone 手法: X-RAY DIFFRACTION / 解像度: 1.84 Å PDB-7qck: Structure of SARS-CoV-2 Papain-like Protease bound to N-(2,5-dihydroxybenzylidene)-thiosemicarbazone 手法: X-RAY DIFFRACTION / 解像度: 1.92 Å PDB-7qcm: Structure of SARS-CoV-2 Papain-like Protease bound to N-(3-methoxy-4-hydroxy-acetophenone)thiosemicarbazone 手法: X-RAY DIFFRACTION / 解像度: 1.77 Å |
---|
化合物 | ChemComp-DZI: 3,4,5-tris(oxidanyl)-N-[(E)-1H-pyrrol-2-ylmethylideneamino]benzamide
ChemComp-A5I: N-(3,5-dimetoxy-4-hydroxybenzyliden)thiosemicarbazone
ChemComp-A6Q: N-(3,4-dihydroxybenzylidene)-thiosemicarbazone
ChemComp-A7L: N-(2,5-dihydroxybenzylidene)-thiosemicarbazone
ChemComp-A3X: N-(3-metoxy-4-hydroxy-acetophenone)thiosemicarbazone
|
---|
由来 | ![](img/tx_virus.gif) severe acute respiratory syndrome coronavirus 2 (ウイルス)
|
---|
キーワード | HYDROLASE / Cystein-Protease / Inhibitor / SARS-CoV-2 / Hydrazone / Deubiquitination / Thiosemicarbazone |
---|