4HYP

Pyrrolopyrimidine inhibitors of dna gyrase b and topoisomerase iv, part i: structure guided discovery and optimization of dual targeting agents with potent, broad-spectrum enzymatic activity.

4HYP の概要

• エントリーDOI: 10.2210/pdb4hyp/pdb
• 関連するPDBエントリー: 4GEE 4GFN 4GGL 4HXW 4HXZ 4HY1 4HYM 4HZ0 4HZ5
• 分子名称: DNA gyrase subunit B, N-[7-(1H-imidazol-1-yl)-2-(pyridin-3-yl)[1,3]thiazolo[5,4-d]pyrimidin-5-yl]cyclopropanecarboxamide, MAGNESIUM ION, ... (4 entities in total)
• 機能のキーワード: gyrase, gyrb, atp-binding, nucleotide-binding, topoisomerase, atp-binding domain, isomerase-isomerase inhibitor complex, isomerase/isomerase inhibitor
• 由来する生物種: Escherichia coli
• 細胞内の位置: Cytoplasm (Potential): P0AES6
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 96953.89

構造登録者

Bensen, D.C.,Creighton, C.J.,Tari, L.W. (登録日: 2012-11-13, 公開日: 2013-02-13, 最終更新日: 2024-02-28)

• 主引用文献: Tari, L.W.,Trzoss, M.,Bensen, D.C.,Li, X.,Chen, Z.,Lam, T.,Zhang, J.,Creighton, C.J.,Cunningham, M.L.,Kwan, B.,Stidham, M.,Shaw, K.J.,Lightstone, F.C.,Wong, S.E.,Nguyen, T.B.,Nix, J.,Finn, J.; Pyrrolopyrimidine inhibitors of DNA gyrase B (GyrB) and topoisomerase IV (ParE). Part I: Structure guided discovery and optimization of dual targeting agents with potent, broad-spectrum enzymatic activity.; Bioorg.Med.Chem.Lett., 23:1529-1536, 2013; PubMed: 23352267; DOI: 10.1016/j.bmcl.2012.11.032

実験手法

X-RAY DIFFRACTION (2.6 Å)