2PG2

Crystal structure of KSP in complex with ADP and thiophene containing inhibitor 15

2PG2 の概要

• エントリーDOI: 10.2210/pdb2pg2/pdb
• 分子名称: Kinesin-like protein KIF11, MAGNESIUM ION, ADENOSINE-5'-DIPHOSPHATE, ... (5 entities in total)
• 機能のキーワード: kinesin spindle protein; ksp; eg5; complex; inhibitor; thiophene, motor protein, cell cycle
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Cytoplasm: P52732
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 83739.19

構造登録者

Lee, T.T. (登録日: 2007-04-06, 公開日: 2007-06-05, 最終更新日: 2023-08-30)

主引用文献

Pinkerton, A.B.,Lee, T.T.,Hoffman, T.Z.,Wang, Y.,Kahraman, M.,Cook, T.G.,Severance, D.,Gahman, T.C.,Noble, S.A.,Shiau, A.K.,Davis, R.L.
Synthesis and SAR of thiophene containing kinesin spindle protein (KSP) inhibitors
Bioorg.Med.Chem.Lett., 17:3562-3569, 2007

PubMed Abstract: We have identified and synthesized a series of thiophene containing inhibitors of kinesin spindle protein. SAR studies led to the synthesis of 33, which was co-crystallized with KSP and determined to bind to an allosteric pocket previously described for other known KSP inhibitors.

PubMed: 17498954
DOI: 10.1016/j.bmcl.2007.04.076

実験手法

X-RAY DIFFRACTION (1.849 Å)