4XJ0

Crystal structure of ERK2 in complex with an inhibitor 14K

Summary for 4XJ0

• Entry DOI: 10.2210/pdb4xj0/pdb
• Descriptor: Mitogen-activated protein kinase 1, 1-[(1S)-1-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]-4-[2-(tetrahydro-2H-pyran-4-ylamino)pyrimidin-4-yl]pyridin-2(1H)-one (3 entities in total)
• Functional Keywords: protein kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (Human)
• Cellular location: Cytoplasm, cytoskeleton, spindle : P28482
• Total number of polymer chains: 2
• Total formula weight: 82257.12

Authors

Yin, J.,Wang, W. (deposition date: 2015-01-08, release date: 2015-09-16, Last modification date: 2023-09-27)

• Primary citation: Ren, L.,Grina, J.,Moreno, D.,Blake, J.F.,Gaudino, J.J.,Garrey, R.,Metcalf, A.T.,Burkard, M.,Martinson, M.,Rasor, K.,Chen, H.,Dean, B.,Gould, S.E.,Pacheco, P.,Shahidi-Latham, S.,Yin, J.,West, K.,Wang, W.,Moffat, J.G.,Schwarz, J.B.; Discovery of highly potent, selective, and efficacious small molecule inhibitors of ERK1/2.; J.Med.Chem., 58:1976-1991, 2015; PubMed: 25603482; DOI: 10.1021/jm501921k

Experimental method

X-RAY DIFFRACTION (2.58 Å)