6HV0
IRE1 kinase/RNase in complex with imidazo[1,2-b]pyridazin-8-amine compound 33
Summary for 6HV0
Entry DOI | 10.2210/pdb6hv0/pdb |
Descriptor | Serine/threonine-protein kinase/endoribonuclease IRE1, 6-chloranyl-3-(2~{H}-indazol-5-yl)-~{N}-propan-2-yl-imidazo[1,2-b]pyridazin-8-amine (3 entities in total) |
Functional Keywords | unfolded protein response allosteric inhibitor, signaling protein |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 48082.60 |
Authors | Bayliss, R.,Bhatia, C.,Collins, I. (deposition date: 2018-10-09, release date: 2019-02-27, Last modification date: 2024-01-24) |
Primary citation | Colombano, G.,Caldwell, J.J.,Matthews, T.P.,Bhatia, C.,Joshi, A.,McHardy, T.,Mok, N.Y.,Newbatt, Y.,Pickard, L.,Strover, J.,Hedayat, S.,Walton, M.I.,Myers, S.M.,Jones, A.M.,Saville, H.,McAndrew, C.,Burke, R.,Eccles, S.A.,Davies, F.E.,Bayliss, R.,Collins, I. Binding to an Unusual Inactive Kinase Conformation by Highly Selective Inhibitors of Inositol-Requiring Enzyme 1 alpha Kinase-Endoribonuclease. J.Med.Chem., 62:2447-2465, 2019 Cited by PubMed: 30779566DOI: 10.1021/acs.jmedchem.8b01721 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.73 Å) |
Structure validation
Download full validation report