8FUR

Crystal structure of human IDO1 with compound 11

Summary for 8FUR

Entry DOI	10.2210/pdb8fur/pdb
Descriptor	Indoleamine 2,3-dioxygenase 1, N-(4-methylphenyl)-N'-[(1P,2'P)-4-propoxy-5-propyl-2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-3-yl]urea (3 entities in total)
Functional Keywords	indoleamine-2, 3-dioxygenase, tryptophan catabolism, kynurenine, oxidoreductase, oxidoreductase-inhibitor complex, oxidoreductase/inhibitor
Biological source	Homo sapiens (human)
Total number of polymer chains	4
Total formula weight	184548.18
Authors	Critton, D.A.,Lewis, H.A. (deposition date: 2023-01-18, release date: 2023-04-26, Last modification date: 2023-05-03)
Primary citation	Markwalder, J.A.,Balog, A.J.,Williams, D.K.,Nara, S.J.,Reddy, R.,Roy, S.,Kanyaboina, Y.,Li, X.,Johnston, K.,Fan, Y.,Lewis, H.,Marsilio, F.,Yan, C.,Critton, D.,Newitt, J.A.,Traeger, S.C.,Wu, D.R.,Jure-Kunkel, M.N.,Jayaraman, L.,Lin, T.A.,Sinz, M.W.,Hunt, J.T.,Seitz, S.P. Synthesis and biological evaluation of biaryl alkyl ethers as inhibitors of IDO1. Bioorg.Med.Chem.Lett., 88:129280-129280, 2023 Cited by PubMed: 37054759 DOI: 10.1016/j.bmcl.2023.129280 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.285 Å)

Structure validation