タイトル | Targeting Prolyl-tRNA Synthetase to Accelerate Drug Discovery against Malaria, Leishmaniasis, Toxoplasmosis, Cryptosporidiosis, and Coccidiosis |
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ジャーナル・号・ページ | Structure, Vol. 25, Page 1495-1505.e6, Year 2017 |
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掲載日 | 2017年4月26日 (構造データの登録日) |
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著者 | Jain, V. / Yogavel, M. / Kikuchi, H. / Oshima, Y. / Hariguchi, N. / Matsumoto, M. / Goel, P. / Touquet, B. / Jumani, R.S. / Tacchini-Cottier, F. ...Jain, V. / Yogavel, M. / Kikuchi, H. / Oshima, Y. / Hariguchi, N. / Matsumoto, M. / Goel, P. / Touquet, B. / Jumani, R.S. / Tacchini-Cottier, F. / Harlos, K. / Huston, C.D. / Hakimi, M.A. / Sharma, A. |
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リンク | Structure / PubMed:28867614 |
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手法 | X線回折 |
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解像度 | 1.9 - 3.1 Å |
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構造データ | PDB-5xif: Crystal Structure of Prolyl-tRNA Synthetase (PRS) from Toxoplasma gondii 手法: X-RAY DIFFRACTION / 解像度: 2.48 Å PDB-5xig: Crystal Structure of Toxoplasma gondii Prolyl-tRNA Synthetase (TgPRS) in complex with Inhibitor 1 手法: X-RAY DIFFRACTION / 解像度: 2.41 Å PDB-5xih: Crystal Structure of Toxoplasma gondii Prolyl-tRNA Synthetase (TgPRS) in complex with inhibitor 5 手法: X-RAY DIFFRACTION / 解像度: 2.2 Å PDB-5xii: Crystal Structure of Toxoplasma gondii Prolyl-tRNA Synthetase (TgPRS) in complex with inhibitor 6 手法: X-RAY DIFFRACTION / 解像度: 2.17 Å PDB-5xij: Crystal Structure of Toxoplasma gondii Prolyl-tRNA Synthetase (TgPRS) in complex with Inhibitor 9 手法: X-RAY DIFFRACTION / 解像度: 2.5 Å PDB-5xik: Crystal Structure of Toxoplasma gondii Prolyl-tRNA Synthetase (TgPRS) in complex with tetrahydro quinazolinone febrifugine 手法: X-RAY DIFFRACTION / 解像度: 2.5 Å PDB-5xil: Crystal Structure of Leishmania major Prolyl-tRNA Synthetase (LmPRS) 手法: X-RAY DIFFRACTION / 解像度: 1.9 Å PDB-5xio: Crystal Structure of Cryptosporidium parvum Prolyl-tRNA Synthetase (CpPRS) in complex with Halofuginone 手法: X-RAY DIFFRACTION / 解像度: 2.46 Å PDB-5xip: Crystal Structure of Eimeria tenella Prolyl-tRNA Synthetase (EtPRS) in complex with Halofuginone 手法: X-RAY DIFFRACTION / 解像度: 3.1 Å PDB-5xiq: Crystal Structure of Toxoplasma gondii Prolyl-tRNA Synthetase (TgPRS) in complex with Halofuginone 手法: X-RAY DIFFRACTION / 解像度: 2.19 Å |
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化合物 | ChemComp-ANP: PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER / AMP-PNP / AMP-PNP, エネルギー貯蔵分子類似体*YM
ChemComp-87F: 3-[3-[(2R)-3-oxidanylidenepiperidin-2-yl]propyl]quinazolin-4-one
ChemComp-86U: 6,7-bis(fluoranyl)-3-[3-[(2R)-3-oxidanylidenepiperidin-2-yl]propyl]quinazolin-4-one
ChemComp-86X: 6-chloranyl-7-fluoranyl-3-[3-[(2R)-3-oxidanylidenepiperidin-2-yl]propyl]quinazolin-4-one
ChemComp-873: 3-[(2R)-2-oxidanyl-3-[(2R,3R)-3-oxidanylpiperidin-2-yl]propyl]quinazolin-4-one
ChemComp-87C: 3-[2-oxidanylidene-3-[(2R,3R)-3-oxidanylpiperidin-2-yl]propyl]-5,6,7,8-tetrahydroquinazolin-4-one
ChemComp-HFG: 7-bromo-6-chloro-3-{3-[(2R,3S)-3-hydroxypiperidin-2-yl]-2-oxopropyl}quinazolin-4(3H)-one / (+)-ハロフギノン / alkaloid, 薬剤*YM
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由来 | - toxoplasma gondii (strain atcc 50611 / me49) (トキソプラズマ)
- leishmania major (大形リーシュマニア)
- cryptosporidium parvum (小形クリプトスポリジウム)
- eimeria tenella (鶏盲腸コクシジウム)
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キーワード | LIGASE / Protein Translation / PRS / Synthetase / Inhibitor / Infectious Disease |
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