EMDB/PDB/SASBDBから引用されている文献のデータベース

キーワード
構造解析手法	All X線回折 NMR 電子顕微鏡小角散乱中性子線回折線維回折粉末回折赤外分光 EPR FRET 理論モデルハイブリッド
著者・登録者
ジャーナル
IF	>30 >20 >10 >5 all

タイトル	Structure-Guided Discovery of Potent Antifungals that Prevent Ras Signaling by Inhibiting Protein Farnesyltransferase.
ジャーナル・号・ページ	J. Med. Chem., Vol. 65, Page 13753-13770, Year 2022
掲載日	2021年11月29日 (構造データの登録日)
著者	Wang, Y. / Xu, F. / Nichols, C.B. / Shi, Y. / Hellinga, H.W. / Alspaugh, J.A. / Distefano, M.D. / Beese, L.S.
リンク	J. Med. Chem. / PubMed:36218371
手法	X線回折
解像度	1.803 - 2.844 Å
構造データ	PDB-7t08: Cryptococcus neoformans protein farnesyltransferase in complex with FPP and inhibitor 2q 手法: X-RAY DIFFRACTION / 解像度: 1.803 Å PDB-7t09: Cryptococcus neoformans protein farnesyltransferase in complex with FPP and inhibitor 2d 手法: X-RAY DIFFRACTION / 解像度: 1.984 Å PDB-7t0a: Cryptococcus neoformans protein farnesyltransferase co-crystallized with FPP and inhibitor 2f 手法: X-RAY DIFFRACTION / 解像度: 2.099 Å PDB-7t0b: Cryptococcus neoformans protein farnesyltransferase in complex with FPP and inhibitor 2g 手法: X-RAY DIFFRACTION / 解像度: 2.026 Å PDB-7t0c: Cryptococcus neoformans protein farnesyltransferase in complex with FPP and inhibitor 2e 手法: X-RAY DIFFRACTION / 解像度: 1.903 Å PDB-7t0d: Cryptococcus neoformans protein farnesyltransferase in complex with FPP and inhibitor 2k 手法: X-RAY DIFFRACTION / 解像度: 1.906 Å PDB-7t0e: Cryptococcus neoformans protein farnesyltransferase in complex with FPP and inhibitor 2b 手法: X-RAY DIFFRACTION / 解像度: 2.223 Å PDB-8e9e: Rat protein farnesyltransferase in complex with FPP and inhibitor 2f 手法: X-RAY DIFFRACTION / 解像度: 2.844 Å
化合物	ChemComp-EDO: 1,2-ETHANEDIOL / エチレングリコ-ル ChemComp-ZN: Unknown entry ChemComp-3FX: (2R)-3-(cyclohexylamino)-2-hydroxypropane-1-sulfonic acid ChemComp-XO1: 4-{[5-({(2S)-2-butyl-5-oxo-4-[3-(trifluoromethoxy)phenyl]piperazin-1-yl}methyl)-1H-imidazol-1-yl]methyl}-2-fluorobenzonitrile ChemComp-FPP: FARNESYL DIPHOSPHATE / ファルネシル二りん酸 ChemComp-HOH: WATER ChemComp-XMV: 4-{[5-({(2S)-2-butyl-5-oxo-4-[3-(trifluoromethoxy)phenyl]piperazin-1-yl}methyl)-1H-imidazol-1-yl]methyl}benzonitrile / 4-[[5-[[(2S)-2-ブチル-4-[3-(トリフルオロメトキシ)フェニル]-5-オキソピペラジノ]メチル]-1(以下略) ChemComp-XMY: (5S)-4-({1-[(4-bromophenyl)methyl]-1H-imidazol-5-yl}methyl)-5-butyl-1-[3-(trifluoromethoxy)phenyl]piperazin-2-one ChemComp-SO4: SULFATE ION / 硫酸ジアニオン ChemComp-XO4: (5S)-5-butyl-4-({1-[(4-fluorophenyl)methyl]-1H-imidazol-5-yl}methyl)-1-[3-(trifluoromethoxy)phenyl]piperazin-2-one ChemComp-XN4: (5S)-5-butyl-4-({1-[(4-chlorophenyl)methyl]-1H-imidazol-5-yl}methyl)-1-[3-(trifluoromethoxy)phenyl]piperazin-2-one ChemComp-XO7: (5S)-4-({1-[(4-bromophenyl)methyl]-1H-imidazol-5-yl}methyl)-5-propyl-1-[3-(trifluoromethoxy)phenyl]piperazin-2-one ChemComp-XOA: (5S)-4-({1-[(4-bromophenyl)methyl]-1H-imidazol-5-yl}methyl)-5-butyl-1-(3-chlorophenyl)piperazin-2-one ChemComp-TRS: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL / トリス(ヒドロキシメチル)メチルアンモニウム / pH緩衝剤*YM
由来	cryptococcus neoformans var. grubii serotype a (strain h99 / atcc 208821 / cbs 10515 / fgsc 9487) (菌類) cryptococcus neoformans var. grubii h99 (菌類) rattus norvegicus (ドブネズミ)
キーワード	TRANSFERASE/TRANSFERASE INHIBITOR / Inhibitor / Antifungal / TRANSFERASE / TRANSFERASE-Inhibitor complex / TRANSFERASE-TRANSFERASE INHIBITOR complex / TRANSFERASE/INHIBITOR / Protein prenylyltransferase