タイトル | A New Class of Multimerization Selective Inhibitors of HIV-1 Integrase. |
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ジャーナル・号・ページ | Plos Pathog., Vol. 10, Page e1004171-e1004171, Year 2014 |
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掲載日 | 2013年12月13日 (構造データの登録日) |
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著者 | Sharma, A. / Slaughter, A. / Jena, N. / Feng, L. / Kessl, J.J. / Fadel, H.J. / Malani, N. / Male, F. / Wu, L. / Poeschla, E. ...Sharma, A. / Slaughter, A. / Jena, N. / Feng, L. / Kessl, J.J. / Fadel, H.J. / Malani, N. / Male, F. / Wu, L. / Poeschla, E. / Bushman, F.D. / Fuchs, J.R. / Kvaratskhelia, M. |
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リンク | Plos Pathog. / PubMed:24874515 |
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手法 | X線回折 |
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解像度 | 2.05 - 2.37 Å |
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構造データ | PDB-4o0j: HIV-1 Integrase Catalytic Core Domain Complexed with Allosteric Inhibitor (2S)-tert-butoxy[4-(4-chlorophenyl)-6-(3,4-dimethylphenyl)-2,5-dimethylpyridin-3-yl]ethanoic acid 手法: X-RAY DIFFRACTION / 解像度: 2.05 Å PDB-4o55: HIV-1 Integrase Catalytic Core Domain Complexed with Allosteric Inhibitor (2S)-tert-butoxy[6-(5-chloro-1H-benzimidazol-2-yl)-2,5-dimethyl-4-phenylpyridin-3-yl]ethanoic acid 手法: X-RAY DIFFRACTION / 解像度: 2.24 Å PDB-4o5b: HIV-1 Integrase Catalytic Core Domain Complexed with Allosteric Inhibitor (2S)-tert-butoxy[6-(5-chloro-1H-benzimidazol-2-yl)-2,5-dimethyl-4-phenylpyridin-3-yl]ethanoic acid 手法: X-RAY DIFFRACTION / 解像度: 2.37 Å |
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化合物 | ChemComp-LF8: (2S)-tert-butoxy[4-(4-chlorophenyl)-6-(3,4-dimethylphenyl)-2,5-dimethylpyridin-3-yl]ethanoic acid
ChemComp-LF9: (2S)-tert-butoxy[6-(5-chloro-1H-benzimidazol-2-yl)-2,5-dimethyl-4-phenylpyridin-3-yl]ethanoic acid
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由来 | ![](img/tx_virus.gif) human immunodeficiency virus type 1 (ヒト免疫不全ウイルス)
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キーワード | VIRAL PROTEIN/INHIBITOR / HIV Integrase / CCD / DDE motif / allosteric inhibitor / VIRAL PROTEIN-INHIBITOR complex / VIRAL PROTEIN |
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