3IN3

Bace1 with Compound 30

Summary for 3IN3

Entry DOI	10.2210/pdb3in3/pdb
Related	3IN4
Descriptor	Beta-secretase 1, (5S)-2-amino-3-methyl-5-pyridin-4-yl-5-(3-pyridin-3-ylphenyl)-3,5-dihydro-4H-imidazol-4-one (3 entities in total)
Functional Keywords	bace1, inhibitor, alternative splicing, aspartyl protease, disulfide bond, glycoprotein, hydrolase, membrane, polymorphism, protease, transmembrane, zymogen
Biological source	Homo sapiens (human)
Cellular location	Membrane; Single-pass type I membrane protein: P56817
Total number of polymer chains	1
Total formula weight	46784.36
Authors	Olland, A.M. (deposition date: 2009-08-11, release date: 2010-01-19, Last modification date: 2011-07-13)
Primary citation	Malamas, M.S.,Barnes, K.,Johnson, M.,Hui, Y.,Zhou, P.,Turner, J.,Hu, Y.,Wagner, E.,Fan, K.,Chopra, R.,Olland, A.,Bard, J.,Pangalos, M.,Reinhart, P.,Robichaud, A.J. Di-substituted pyridinyl aminohydantoins as potent and highly selective human beta-secretase (BACE1) inhibitors. Bioorg.Med.Chem., 18:630-639, 2010 Cited by PubMed: 20045648 DOI: 10.1016/j.bmc.2009.12.007 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2 Å)

Structure validation