7U9S

Crystal structure of human D-amino acid oxidase in complex with inhibitor

Summary for 7U9S

Entry DOI	10.2210/pdb7u9s/pdb
Descriptor	D-amino-acid oxidase, FLAVIN-ADENINE DINUCLEOTIDE, 5-{2-[4-(trifluoromethyl)phenyl]ethyl}-1,4-dihydropyrazine-2,3-dione, ... (4 entities in total)
Functional Keywords	fad, flavoprotein, oxidoreductase, peroxisome, oxidoreductase-inhibitor complex, oxidoreductase/inhibitor
Biological source	Homo sapiens (human)
Total number of polymer chains	2
Total formula weight	81181.39
Authors	Skene, R.J.,Bell, J.A. (deposition date: 2022-03-11, release date: 2022-06-08, Last modification date: 2023-10-18)
Primary citation	Tang, H.,Jensen, K.,Houang, E.,McRobb, F.M.,Bhat, S.,Svensson, M.,Bochevarov, A.,Day, T.,Dahlgren, M.K.,Bell, J.A.,Frye, L.,Skene, R.J.,Lewis, J.H.,Osborne, J.D.,Tierney, J.P.,Gordon, J.A.,Palomero, M.A.,Gallati, C.,Chapman, R.S.L.,Jones, D.R.,Hirst, K.L.,Sephton, M.,Chauhan, A.,Sharpe, A.,Tardia, P.,Dechaux, E.A.,Taylor, A.,Waddell, R.D.,Valentine, A.,Janssens, H.B.,Aziz, O.,Bloomfield, D.E.,Ladha, S.,Fraser, I.J.,Ellard, J.M. Discovery of a Novel Class of d-Amino Acid Oxidase Inhibitors Using the Schrodinger Computational Platform. J.Med.Chem., 65:6775-6802, 2022 Cited by PubMed: 35482677 DOI: 10.1021/acs.jmedchem.2c00118 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.1 Å)

Structure validation