5CF8

CRYSTAL STRUCTURE OF JANUS KINASE 2 IN COMPLEX WITH N,N-DICYCLOPROPYL-10-ETHYL-7-[(3-METHOXYPROPYL)AMINO] -3-METHYL-3,5,8,10-TETRAAZATRICYCLO[7.3.0.0,6] DODECA-1(9),2(6),4,7,11-PENTAENE-11-CARBOXAMIDE

Summary for 5CF8

Entry DOI	10.2210/pdb5cf8/pdb
Related	5CF4 5CF5 5CF6
Descriptor	Tyrosine-protein kinase JAK2, N,N-dicyclopropyl-4-[(1,5-dimethyl-1H-pyrazol-3-yl)amino]-6-ethyl-1-methyl-1,6-dihydroimidazo[4,5-d]pyrrolo[2,3-b]pyridine-7-carboxamide (3 entities in total)
Functional Keywords	kinase, transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological source	Homo sapiens (Human)
Cellular location	Endomembrane system ; Peripheral membrane protein : O60674
Total number of polymer chains	2
Total formula weight	72256.27
Authors	Sack, J.S. (deposition date: 2015-07-08, release date: 2015-08-26, Last modification date: 2017-11-22)
Primary citation	Wan, H.,Schroeder, G.M.,Hart, A.C.,Inghrim, J.,Grebinski, J.,Tokarski, J.S.,Lorenzi, M.V.,You, D.,Mcdevitt, T.,Penhallow, B.,Vuppugalla, R.,Zhang, Y.,Gu, X.,Iyer, R.,Lombardo, L.J.,Trainor, G.L.,Ruepp, S.,Lippy, J.,Blat, Y.,Sack, J.S.,Khan, J.A.,Stefanski, K.,Sleczka, B.,Mathur, A.,Sun, J.H.,Wong, M.K.,Wu, D.R.,Li, P.,Gupta, A.,Arunachalam, P.N.,Pragalathan, B.,Narayanan, S.,K C, N.,Kuppusamy, P.,Purandare, A.V. Discovery of a Highly Selective JAK2 Inhibitor, BMS-911543, for the Treatment of Myeloproliferative Neoplasms. Acs Med.Chem.Lett., 6:850-855, 2015 Cited by PubMed: 26288683 DOI: 10.1021/acsmedchemlett.5b00226 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.8 Å)

Structure validation