3KE1

Crystal structure of 2C-methyl-D-erythritol 2,4-cyclodiphosphate synthase from Burkholderia pseudomallei in complex with a fragment-nucleoside fusion D000161829

3KE1 の概要

• エントリーDOI: 10.2210/pdb3ke1/pdb
• 関連するPDBエントリー: 3ieq 3ike 3ikf 3jvh 3k14 3k2x
• 分子名称: 2-C-methyl-D-erythritol 2,4-cyclodiphosphate synthase, ZINC ION, 5'-deoxy-5'-[(pyridin-4-ylcarbonyl)amino]cytidine, ... (5 entities in total)
• 機能のキーワード: niaid, ssgcid, seattle structural genomics center for infectious disease, fragment crystallography, fbdd, fragment-based drug-design, nucleoside analog, d000161829, isoprene biosynthesis, lyase, metal-binding
• 由来する生物種: Burkholderia pseudomallei (Pseudomonas pseudomallei)
• タンパク質・核酸の鎖数: 3
• 化学式量合計: 59738.63

構造登録者

Seattle Structural Genomics Center for Infectious Disease (SSGCID) (登録日: 2009-10-23, 公開日: 2009-11-10, 最終更新日: 2023-09-06)

• 主引用文献: Zhang, Z.,Jakkaraju, S.,Blain, J.,Gogol, K.,Zhao, L.,Hartley, R.C.,Karlsson, C.A.,Staker, B.L.,Edwards, T.E.,Stewart, L.J.,Myler, P.J.,Clare, M.,Begley, D.W.,Horn, J.R.,Hagen, T.J.; Cytidine derivatives as IspF inhibitors of Burkolderia pseudomallei.; Bioorg.Med.Chem.Lett., 8:e53851-e53851, 2013; PubMed: 24157367; DOI: 10.1016/j.bmcl.2013.09.101

実験手法

X-RAY DIFFRACTION (2.05 Å)