6AAK

Crystal structure of JAK3 in complex with peficitinib

Summary for 6AAK

Entry DOI	10.2210/pdb6aak/pdb
Descriptor	Tyrosine-protein kinase JAK3, 4-[[(1S,3R)-5-oxidanyl-2-adamantyl]amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide (3 entities in total)
Functional Keywords	protein kinase, transferase-inhibitor complex, transferase/inhibitor
Biological source	Homo sapiens (Human)
Total number of polymer chains	4
Total formula weight	132739.29
Authors	Amano, Y. (deposition date: 2018-07-18, release date: 2018-08-15, Last modification date: 2018-10-24)
Primary citation	Hamaguchi, H.,Amano, Y.,Moritomo, A.,Shirakami, S.,Nakajima, Y.,Nakai, K.,Nomura, N.,Ito, M.,Higashi, Y.,Inoue, T. Discovery and structural characterization of peficitinib (ASP015K) as a novel and potent JAK inhibitor Bioorg. Med. Chem., 26:4971-4983, 2018 Cited by PubMed: 30145050 DOI: 10.1016/j.bmc.2018.08.005 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.67 Å)

Structure validation