6GCX

Focal Adhesion Kinase catalytic domain in complex with irreversible inhibitor

Summary for 6GCX

• Entry DOI: 10.2210/pdb6gcx/pdb
• Related: 6GCR 6GCW
• Descriptor: Focal adhesion kinase 1, 2-[[2-[[4-[[[3,4-bis(oxidanylidene)-2-[2-(propanoylamino)ethylamino]cyclobuten-1-yl]amino]methyl]phenyl]amino]-5-chloranyl-pyrimidin-4-yl]amino]-~{N}-methyl-benzamide, SULFATE ION, ... (4 entities in total)
• Functional Keywords: focal adhesion kinase cell adhesion signalling irreversible inhibitor 2, 4-pyrimidine derivatives, cell adhesion
• Biological source: Gallus gallus (Chicken)
• Total number of polymer chains: 1
• Total formula weight: 32500.97

Authors

Yen-Pon, E.,Li, B.,Acebron-Garcia de Eulate, M.,Tomkiewicz-Raulet, C.,Dawson, J.,Lietha, D.,Frame, M.C.,Coumoul, X.,Garbay, C.,Etheve-Quelquejeu, M.,Chen, H. (deposition date: 2018-04-19, release date: 2019-05-01, Last modification date: 2019-10-02)

• Primary citation: Yen-Pon, E.,Li, B.,Acebron-Garcia-de-Eulate, M.,Tomkiewicz-Raulet, C.,Dawson, J.,Lietha, D.,Frame, M.C.,Coumoul, X.,Garbay, C.,Etheve-Quelquejeu, M.,Chen, H.; Structure-Based Design, Synthesis, and Characterization of the First Irreversible Inhibitor of Focal Adhesion Kinase.; Acs Chem.Biol., 13:2067-2073, 2018; PubMed: 29897729; DOI: 10.1021/acschembio.8b00250

Experimental method

X-RAY DIFFRACTION (1.553 Å)