タイトル | Impact of linker strain and flexibility in the design of a fragment-based inhibitor |
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ジャーナル・号・ページ | Nat. Chem. Biol., Vol. 5, Page 407-413, Year 2009 |
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掲載日 | 2008年11月21日 (構造データの登録日) |
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著者 | Chung, S. / Parker, J.B. / Bianchet, M. / Amzel, L.M. / Stivers, J.T. |
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リンク | Nat. Chem. Biol. / PubMed:19396178 |
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手法 | X線回折 |
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解像度 | 1.27 - 1.84 Å |
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構造データ | PDB-3fcf: Complex of UNG2 and a fragment-based designed inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.84 Å PDB-3fci: Complex of UNG2 and a fragment-based designed inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.27 Å PDB-3fck: Complex of UNG2 and a fragment-based design inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.64 Å PDB-3fcl: Complex of UNG2 and a fragment-based designed inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.7 Å |
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化合物 | ChemComp-FCF: 3-[(1E,7E)-8-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-3,6-dioxa-2,7-diazaocta-1,7-dien-1-yl]benzoic acid
ChemComp-3FI: 3-{(E)-[(3-{[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]amino}propoxy)imino]methyl}benzoic acid
ChemComp-FCK: 3-({[3-({[(1E)-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methylidene]amino}oxy)propyl]amino}methyl)benzoic acid
ChemComp-3FL: 3-{[(4-{[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]amino}butyl)amino]methyl}benzoic acid
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由来 | homo sapiens (ヒト)
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キーワード | HYDROLASE / DNA REPAIR / URACIL / URACIL DNA GLYCOSYLASE / Alternative splicing / Disease mutation / DNA damage / Glycosidase / Host-virus interaction / Mitochondrion / Nucleus / Phosphoprotein / Transit peptide |
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