6HMX
RIP2 Kinase Catalytic Domain complex with N(4,5dimethyl1Hpyrazol3yl)7methoxy6(2methylpropane2sulfonyl)quinolin4amine
Summary for 6HMX
Entry DOI | 10.2210/pdb6hmx/pdb |
Descriptor | Receptor-interacting serine/threonine-protein kinase 2, 6-~{tert}-butylsulfonyl-~{N}-(3,4-dimethyl-1~{H}-pyrazol-5-yl)-7-methoxy-quinolin-4-amine (3 entities in total) |
Functional Keywords | kinase, kinase inhibitor, complex, structure based drug discovery, transferase |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 2 |
Total formula weight | 72142.92 |
Authors | Convery, M.A.,Haile, P.A. (deposition date: 2018-09-13, release date: 2018-11-07, Last modification date: 2024-05-15) |
Primary citation | Haile, P.A.,Casillas, L.N.,Bury, M.J.,Mehlmann, J.F.,Singhaus Jr., R.,Charnley, A.K.,Hughes, T.V.,DeMartino, M.P.,Wang, G.Z.,Romano, J.J.,Dong, X.,Plotnikov, N.V.,Lakdawala, A.S.,Convery, M.A.,Votta, B.J.,Lipshutz, D.B.,Desai, B.M.,Swift, B.,Capriotti, C.A.,Berger, S.B.,Mahajan, M.K.,Reilly, M.A.,Rivera, E.J.,Sun, H.H.,Nagilla, R.,LePage, C.,Ouellette, M.T.,Totoritis, R.D.,Donovan, B.T.,Brown, B.S.,Chaudhary, K.W.,Gough, P.J.,Bertin, J.,Marquis, R.W. Identification of Quinoline-Based RIP2 Kinase Inhibitors with an Improved Therapeutic Index to the hERG Ion Channel. ACS Med Chem Lett, 9:1039-1044, 2018 Cited by PubMed: 30344914DOI: 10.1021/acsmedchemlett.8b00344 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.53 Å) |
Structure validation
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