7ZUN

Crystal structure of PIM1 in complex with a Pyrrolo-Pyrazinone compound

Summary for 7ZUN

Entry DOI	10.2210/pdb7zun/pdb
Descriptor	Isoform 2 of Serine/threonine-protein kinase pim-1, (4~{S})-4-(2-azanylethyl)-6-phenyl-7-[3-(trifluoromethyloxy)phenyl]-3,4-dihydropyrrolo[1,2-a]pyrazin-1-ol (3 entities in total)
Functional Keywords	pim1, atp binding, kinase inhibitor, transferase
Biological source	Homo sapiens (human)
Total number of polymer chains	1
Total formula weight	36251.10
Authors	Casale, E. (deposition date: 2022-05-12, release date: 2022-10-05, Last modification date: 2024-01-31)
Primary citation	Casuscelli, F.,Ardini, E.,Avanzi, N.,Badari, A.,Casale, E.,Disingrini, T.,Donati, D.,Ermoli, A.,Felder, E.R.,Galvani, A.,Isacchi, A.,Menichincheri, M.,Montemartini, M.,Orrenius, C.,Piutti, C.,Salom, B.,Papeo, G. Stereoselective synthesis of 3,4-dihydropyrrolo[1,2-a]pyrazin-1(2H)-one derivatives as PIM kinase inhibitors inspired from marine alkaloids. Chirality, 34:1437-1452, 2022 Cited by PubMed: 35959859 DOI: 10.1002/chir.23501 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.5 Å)

Structure validation