8AO9
Specific covalent inhibitor(10) of ERK2
Summary for 8AO9
Entry DOI | 10.2210/pdb8ao9/pdb |
Descriptor | Mitogen-activated protein kinase 1, SULFATE ION, 1,2-ETHANEDIOL, ... (6 entities in total) |
Functional Keywords | serine-threonine kinase, transcriptional repressor, cell cycle, atp binding, signaling protein |
Biological source | Homo sapiens (human) |
Total number of polymer chains | 1 |
Total formula weight | 43180.63 |
Authors | Cleasby, A. (deposition date: 2022-08-08, release date: 2022-09-28, Last modification date: 2022-10-05) |
Primary citation | St Denis, J.D.,Chessari, G.,Cleasby, A.,Cons, B.D.,Cowan, S.,Dalton, S.E.,East, C.,Murray, C.W.,O'Reilly, M.,Peakman, T.,Rapti, M.,Stow, J.L. X-ray Screening of an Electrophilic Fragment Library and Application toward the Development of a Novel ERK 1/2 Covalent Inhibitor. J.Med.Chem., 65:12319-12333, 2022 Cited by PubMed: 36101934DOI: 10.1021/acs.jmedchem.2c01044 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.624 Å) |
Structure validation
Download full validation report