登録情報 | データベース: PDB / ID: 7ctw |
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タイトル | Wild-type Plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed with fragment 820, NADPH, dUMP |
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要素 | Bifunctional dihydrofolate reductase-thymidylate synthase |
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キーワード | OXIDOREDUCTASE / Anti-folate / anti-malarial / plasmodium falciparum / dihydrofolate reductase / fragment / ANTIBIOTIC |
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機能・相同性 | 機能・相同性情報
thymidylate synthase activity / dTMP biosynthetic process / dihydrofolate reductase activity / tetrahydrofolate biosynthetic process / one-carbon metabolic process / methylation / nucleotide binding / mitochondrion / cytosol類似検索 - 分子機能 Bifunctional dihydrofolate reductase/thymidylate synthase / Thymidylate synthase/dCMP hydroxymethylase / Thymidylate synthase, active site / Thymidylate synthase active site. / Thymidylate synthase / Thymidylate synthase/dCMP hydroxymethylase domain / Thymidylate synthase/dCMP hydroxymethylase superfamily / Thymidylate synthase / Dihydrofolate reductase conserved site / Dihydrofolate reductase (DHFR) domain signature. ...Bifunctional dihydrofolate reductase/thymidylate synthase / Thymidylate synthase/dCMP hydroxymethylase / Thymidylate synthase, active site / Thymidylate synthase active site. / Thymidylate synthase / Thymidylate synthase/dCMP hydroxymethylase domain / Thymidylate synthase/dCMP hydroxymethylase superfamily / Thymidylate synthase / Dihydrofolate reductase conserved site / Dihydrofolate reductase (DHFR) domain signature. / Dihydrofolate reductase domain / Dihydrofolate reductase / Dihydrofolate reductase (DHFR) domain profile. / Dihydrofolate reductase-like domain superfamily類似検索 - ドメイン・相同性 1-(2-methylsulfanylphenyl)piperazine / Chem-NDP / PHOSPHATE ION / Bifunctional dihydrofolate reductase-thymidylate synthase類似検索 - 構成要素 |
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生物種 | ![](img/tx_eukaryote.gif) Plasmodium falciparum (マラリア病原虫) |
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手法 | X線回折 / 分子置換 / 解像度: 2.51 Å |
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データ登録者 | Vanichtanankul, J. / Vitsupakorn, D. |
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資金援助 | タイ, 1件 組織 | 認可番号 | 国 |
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National Center for Genetic Engineering and Biotechnology (Thailand) | P1850116 | タイ |
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引用 | ジャーナル: J Enzyme Inhib Med Chem / 年: 2021 タイトル: Discovery of new non-pyrimidine scaffolds as Plasmodium falciparum DHFR inhibitors by fragment-based screening. 著者: Hoarau, M. / Vanichtanankul, J. / Srimongkolpithak, N. / Vitsupakorn, D. / Yuthavong, Y. / Kamchonwongpaisan, S. |
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履歴 | 登録 | 2020年8月20日 | 登録サイト: PDBJ / 処理サイト: PDBJ |
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改定 1.0 | 2021年4月28日 | Provider: repository / タイプ: Initial release |
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改定 1.1 | 2021年7月7日 | Group: Data collection / カテゴリ: pdbx_reflns_twin / Item: _pdbx_reflns_twin.diffrn_id |
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改定 1.2 | 2023年11月29日 | Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description カテゴリ: atom_type / chem_comp_atom ...atom_type / chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model Item: _atom_type.pdbx_N_electrons / _atom_type.pdbx_scat_Z ..._atom_type.pdbx_N_electrons / _atom_type.pdbx_scat_Z / _database_2.pdbx_DOI / _database_2.pdbx_database_accession |
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