タイトル | Hydroxamic Acid Inhibitors Provide Cross-Species Inhibition of Plasmodium M1 and M17 Aminopeptidases. |
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ジャーナル・号・ページ | J. Med. Chem., Vol. 62, Page 622-640, Year 2019 |
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掲載日 | 2018年8月2日 (構造データの登録日) |
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著者 | Vinh, N.B. / Drinkwater, N. / Malcolm, T.R. / Kassiou, M. / Lucantoni, L. / Grin, P.M. / Butler, G.S. / Duffy, S. / Overall, C.M. / Avery, V.M. ...Vinh, N.B. / Drinkwater, N. / Malcolm, T.R. / Kassiou, M. / Lucantoni, L. / Grin, P.M. / Butler, G.S. / Duffy, S. / Overall, C.M. / Avery, V.M. / Scammells, P.J. / McGowan, S. |
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リンク | J. Med. Chem. / PubMed:30537832 |
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手法 | X線回折 |
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解像度 | 1.35 - 2.3 Å |
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構造データ | PDB-6ea1: X-ray crystal structure of Pf-M1 in complex with inhibitor (6da) and catalytic zinc ion 手法: X-RAY DIFFRACTION / 解像度: 1.815 Å PDB-6ea2: X-ray crystal structure of Pf-M1 in complex with inhibitor (6h) and catalytic zinc ion 手法: X-RAY DIFFRACTION / 解像度: 1.35 Å PDB-6eaa: X-ray crystal structure of Pf-M1 in complex with inhibitor (6i) and catalytic zinc ion 手法: X-RAY DIFFRACTION / 解像度: 1.65 Å PDB-6eab: X-ray crystal structure of Pf-M1 in complex with inhibitor (6j) and catalytic zinc ion 手法: X-RAY DIFFRACTION / 解像度: 1.85 Å PDB-6ee2: X-ray crystal structure of Pf-M17 in complex with inhibitor 6i and regulatory zinc ion 手法: X-RAY DIFFRACTION / 解像度: 2.1 Å PDB-6ee3: X-ray crystal structure of Pf-M1 in complex with inhibitor (6k) and catalytic zinc ion 手法: X-RAY DIFFRACTION / 解像度: 1.82 Å PDB-6ee4: X-ray crystal structure of Pf-M1 in complex with inhibitor (6m) and catalytic zinc ion 手法: X-RAY DIFFRACTION / 解像度: 1.58 Å PDB-6ee6: X-ray crystal structure of Pf-M1 in complex with inhibitor (6o) and catalytic zinc ion 手法: X-RAY DIFFRACTION / 解像度: 1.5 Å PDB-6eed: X-ray crystal structure of Pf-M1 in complex with inhibitor (6p) and catalytic zinc ion 手法: X-RAY DIFFRACTION / 解像度: 1.5 Å PDB-6eee: X-ray crystal structure of Pf-M17 in complex with inhibitor (6k) and regulatory zinc ion 手法: X-RAY DIFFRACTION / 解像度: 2.3 Å |
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化合物 | ChemComp-J0Y: (2R)-2,3,3,3-tetrafluoro-N-[(1R)-2-(hydroxyamino)-2-oxo-1-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)ethyl]propanamide
ChemComp-J1G: N-[(1R)-2-(hydroxyamino)-2-oxo-1-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)ethyl]cyclopentanecarboxamide
ChemComp-J1V: N-[(1R)-2-(hydroxyamino)-2-oxo-1-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)ethyl]cyclohexanecarboxamide
ChemComp-J2D: N-[(1R)-2-(hydroxyamino)-2-oxo-1-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)ethyl]oxane-4-carboxamide
ChemComp-J4V: (1R,2r,3S,5R,7R)-N-[(1R)-2-(hydroxyamino)-2-oxo-1-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)ethyl]tricyclo[3.3.1.1~3,7~]decane-2-carboxamide
ChemComp-J4S: (2R)-2-[(cyclopropylacetyl)amino]-N-hydroxy-2-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)acetamide
ChemComp-J4P: (2R)-2-[(cyclopentylacetyl)amino]-N-hydroxy-2-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)acetamide
ChemComp-J6A: (2R)-2-[(cyclohexylacetyl)amino]-N-hydroxy-2-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)acetamide
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由来 | - plasmodium falciparum (isolate fcb1 / columbia) (マラリア病原虫)
- plasmodium falciparum nf135/5.c10 (マラリア病原虫)
- plasmodium falciparum (isolate hb3) (マラリア病原虫)
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キーワード | hydrolase/hydrolase inhibitor / M1 ALANYL-AMINOPEPTIDASE / PROTEASE / INHIBITOR / HYDROXAMIC ACID / HYDROLASE / hydrolase-hydrolase inhibitor complex / M17 LEUCYL-AMINOPEPTIDASE |
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