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5OQ4

PQR309 - a Potent, Brain-Penetrant, Orally Bioavailable, pan-Class I PI3K/mTOR Inhibitor as Clinical Candidate in Oncology

Summary for 5OQ4
Entry DOI10.2210/pdb5oq4/pdb
DescriptorPhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, 5-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)pyridin-2-amine, SULFATE ION, ... (4 entities in total)
Functional Keywordspi3k, 3-kinase, lipid kinase, kinase, inhibitor, pqr309, ncb5, transferase
Biological sourceHomo sapiens (Human)
Cellular locationCytoplasm : P48736
Total number of polymer chains1
Total formula weight111359.67
Authors
Williams, R.L.,Zhang, X. (deposition date: 2017-08-10, release date: 2017-09-06, Last modification date: 2024-01-17)
Primary citationBeaufils, F.,Cmiljanovic, N.,Cmiljanovic, V.,Bohnacker, T.,Melone, A.,Marone, R.,Jackson, E.,Zhang, X.,Sele, A.,Borsari, C.,Mestan, J.,Hebeisen, P.,Hillmann, P.,Giese, B.,Zvelebil, M.,Fabbro, D.,Williams, R.L.,Rageot, D.,Wymann, M.P.
5-(4,6-Dimorpholino-1,3,5-triazin-2-yl)-4-(trifluoromethyl)pyridin-2-amine (PQR309), a Potent, Brain-Penetrant, Orally Bioavailable, Pan-Class I PI3K/mTOR Inhibitor as Clinical Candidate in Oncology.
J. Med. Chem., 60:7524-7538, 2017
Cited by
PubMed: 28829592
DOI: 10.1021/acs.jmedchem.7b00930
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (2.7 Å)
Structure validation

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