3TDC

Crystal Structure of Human Acetyl-CoA carboxylase 2

3TDC の概要

• エントリーDOI: 10.2210/pdb3tdc/pdb
• 分子名称: Acetyl-CoA carboxylase 2 variant, 1-[3-({4-[(5S)-3,3-dimethyl-1-oxo-2-oxa-7-azaspiro[4.5]dec-7-yl]piperidin-1-yl}carbonyl)-1-benzothiophen-2-yl]-3-ethylurea (3 entities in total)
• 機能のキーワード: biotin, malonyl-coa, carboxylase, ligase-ligase inhibitor complex, ligase/ligase inhibitor
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 87103.67

構造登録者

Dougan, D.R.,Mol, C.D. (登録日: 2011-08-10, 公開日: 2011-10-12, 最終更新日: 2023-09-13)

• 主引用文献: Yamashita, T.,Kamata, M.,Endo, S.,Yamamoto, M.,Kakegawa, K.,Watanabe, H.,Miwa, K.,Yamano, T.,Funata, M.,Sakamoto, J.,Tani, A.,Mol, C.D.,Zou, H.,Dougan, D.R.,Sang, B.,Snell, G.,Fukatsu, K.; Design, synthesis, and structure-activity relationships of spirolactones bearing 2-ureidobenzothiophene as acetyl-CoA carboxylases inhibitors.; Bioorg.Med.Chem.Lett., 21:6314-6318, 2011; PubMed: 21944854; DOI: 10.1016/j.bmcl.2011.08.117

実験手法

X-RAY DIFFRACTION (2.41 Å)