8X3M

Crystal structure of p38alpha with an allosteric inhibitor 2

Summary for 8X3M

Entry DOI	10.2210/pdb8x3m/pdb
Related	7x4u
Descriptor	Mitogen-activated protein kinase 14, ~{N}-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-[(4-fluoranylphenoxy)methyl]-1,3-thiazole-4-carboxamide (3 entities in total)
Functional Keywords	protein kinase mapk family allosteric inhibitor covalent bond, transferase
Biological source	Homo sapiens (human)
Total number of polymer chains	1
Total formula weight	42200.14
Authors	Hasegawa, S.,Kinoshita, T. (deposition date: 2023-11-14, release date: 2024-11-20)
Primary citation	Hasegawa, S.,Mayu, Y.,Haruna, N.,Hajime, S.,Masaki, S.,Kinoshita, T. Distinct binding modes of a benzothiazole derivative provide the structural basis for gaining ERK2 or p38alpha selectivity To Be Published,
Experimental method	X-RAY DIFFRACTION (1.85 Å)

Structure validation