7M5Z

Crystal Structure of the MerTK Kinase Domain in Complex with Inhibitor MIPS15692

Summary for 7M5Z

• Entry DOI: 10.2210/pdb7m5z/pdb
• Descriptor: Tyrosine-protein kinase Mer, 2-(butylamino)-N-[1-(3-fluoropropyl)piperidin-4-yl]-4-{[(1r,4r)-4-hydroxycyclohexyl]amino}pyrimidine-5-carboxamide (3 entities in total)
• Functional Keywords: kinase, signaling protein-inhibitor complex, signaling protein/inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 72904.16

Authors

Hermans, S.J.,Hancock, N.C.,Baell, J.B.,Parker, M.W. (deposition date: 2021-03-25, release date: 2021-10-06, Last modification date: 2023-10-18)

• Primary citation: Wong, S.W.,Vivash, L.,Mudududdla, R.,Nguyen, N.,Hermans, S.J.,Shackleford, D.M.,Field, J.,Xue, L.,Aprico, A.,Hancock, N.C.,Haskali, M.,Stashko, M.A.,Frye, S.V.,Wang, X.,Binder, M.D.,Ackermann, U.,Parker, M.W.,Kilpatrick, T.J.,Baell, J.B.; Development of [ 18 F]MIPS15692, a radiotracer with in vitro proof-of-concept for the imaging of MER tyrosine kinase (MERTK) in neuroinflammatory disease.; Eur.J.Med.Chem., 226:113822-113822, 2021; PubMed: 34563964; DOI: 10.1016/j.ejmech.2021.113822

Experimental method

X-RAY DIFFRACTION (3.06 Å)