6S90

BTK in complex with an inhibitor

Summary for 6S90

Entry DOI	10.2210/pdb6s90/pdb
Descriptor	Tyrosine-protein kinase BTK, 4-~{tert}-butyl-~{N}-[2-methyl-3-[6-[4-(4-methylpiperazin-1-yl)carbonylphenyl]-7~{H}-pyrrolo[2,3-d]pyrimidin-4-yl]phenyl]benzamide (3 entities in total)
Functional Keywords	btk, bruton tyrosine kinase, agammaglobulinaemia tyrosine kinase, atk, b-cell progenitor kinase, transferase
Biological source	Homo sapiens (Human)
Total number of polymer chains	2
Total formula weight	63415.01
Authors	Gutmann, S.,Hinniger, A. (deposition date: 2019-07-11, release date: 2019-09-18, Last modification date: 2019-10-30)
Primary citation	Pulz, R.,Angst, D.,Dawson, J.,Gessier, F.,Gutmann, S.,Hersperger, R.,Hinniger, A.,Janser, P.,Koch, G.,Revesz, L.,Vulpetti, A.,Waelchli, R.,Zimmerlin, A.,Cenni, B. Design of Potent and Selective Covalent Inhibitors of Bruton's Tyrosine Kinase Targeting an Inactive Conformation. Acs Med.Chem.Lett., 10:1467-1472, 2019 Cited by PubMed: 31620235 DOI: 10.1021/acsmedchemlett.9b00317 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.82 Å)

Structure validation