7ZZA

Crystal structure of NAD kinase 1 from Listeria monocytogenes in complex with a linear di-adenosine derivative

7ZZA の概要

• エントリーDOI: 10.2210/pdb7zza/pdb
• 関連するPDBエントリー: 7ZZ7 7ZZ9
• 分子名称: NAD kinase 1, CITRIC ACID, 2-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[3-[6-azanyl-9-[(2~{R},3~{R},4~{S},5~{R})-5-[(3-azanylpropylcarbamoylamino)methyl]-3,4-bis(oxidanyl)oxolan-2-yl]purin-8-yl]prop-2-ynyl]amino]ethanoic acid, ... (4 entities in total)
• 機能のキーワード: tetrameric nad-kinase, transferase
• 由来する生物種: Listeria monocytogenes EGD-e
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 31964.10

構造登録者

Gelin, M.,Labesse, G. (登録日: 2022-05-25, 公開日: 2023-01-11, 最終更新日: 2024-01-31)

• 主引用文献: Clement, D.A.,Gelin, M.,Leseigneur, C.,Huteau, V.,Mondange, L.,Pons, J.L.,Dussurget, O.,Lionne, C.,Labesse, G.,Pochet, S.; Synthesis and structure-activity relationship studies of original cyclic diadenosine derivatives as nanomolar inhibitors of NAD kinase from pathogenic bacteria.; Eur.J.Med.Chem., 246:114941-114941, 2023; PubMed: 36455355; DOI: 10.1016/j.ejmech.2022.114941

実験手法

X-RAY DIFFRACTION (2.05 Å)