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3S7M

Pyrazolyl and Thienyl Aminohydantoins as Potent BACE1 Inhibitors

Summary for 3S7M
Entry DOI10.2210/pdb3s7m/pdb
Related3S7L
DescriptorBeta-secretase 1, (5S)-2-amino-3-methyl-5-[3-(pyridin-3-yl)phenyl]-5-(thiophen-3-yl)-3,5-dihydro-4H-imidazol-4-one (3 entities in total)
Functional Keywordsaspartyl protease, disulfide bond, endoplasmic reticulum, endosome, glycoprotein, golgi apparatus, membrane, protease, transmembrane, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological sourceHomo sapiens (human)
Cellular locationMembrane; Single-pass type I membrane protein: P56817
Total number of polymer chains1
Total formula weight46789.40
Authors
Chopra, R.,Olland, A.,Svenson, K. (deposition date: 2011-05-26, release date: 2011-08-31)
Primary citationMalamas, M.S.,Erdei, J.,Gunawan, I.,Barnes, K.,Hui, Y.,Johnson, M.,Robichaud, A.,Zhou, P.,Yan, Y.,Solvibile, W.,Turner, J.,Fan, K.Y.,Chopra, R.,Bard, J.,Pangalos, M.N.
New pyrazolyl and thienyl aminohydantoins as potent BACE1 inhibitors: Exploring the S2' region.
Bioorg.Med.Chem.Lett., 21:5164-5170, 2011
Cited by
PubMed: 21835615
DOI: 10.1016/j.bmcl.2011.07.057
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (2.2 Å)
Structure validation

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