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4L7G

Diethylaminosulfur Trifluoride-Mediated Intramolecular Cyclization of 2-hydroxy-benzylureas to Fused Bicyclic Aminooxazoline Compounds and Evaluation of Their Biochemical Activity Against Beta-Secretase-1 (BACE1)

Summary for 4L7G
Entry DOI10.2210/pdb4l7g/pdb
Related4L7H 4L7J 4LC7
DescriptorBeta-secretase 1, (3aS,7aR)-7a-[3-(pyrimidin-5-yl)phenyl]-3a,6,7,7a-tetrahydro-4H-pyrano[4,3-d][1,3]oxazol-2-amine, DIMETHYL SULFOXIDE, ... (4 entities in total)
Functional Keywordsaspartic protease, 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 weight45977.66
Authors
Huestis, M.P.,Liu, W.,Volgraf, M.,Purkey, H.,Wang, W.,Yu, C.,Wu, P.,Smith, D.,Vigers, G.,Dutcher, D.,Geck Do, M.K.,Hunt, K.W.,Siu, M. (deposition date: 2013-06-13, release date: 2013-09-18, Last modification date: 2023-09-20)
Primary citationHuestis, M.P.,Liu, W.,Volgraf, M.,Purkey, H.,Yu, C.,Wang, W.,Smith, D.,Vigers, G.,Dutcher, D.,Hunt, K.W.,Siu, M.
Diethylaminosulfur Trifluoride-Mediated Intramolecular Cyclization of 2-hydroxycycloalkylureas to Fused Bicyclic Aminooxazoline Compounds and Evaluation of Their Biochemical Activity Against β-Secretase-1 (BACE-1)
Tetrahedron Lett., 2013
Cited by
DOI: 10.1016/j.tetlet.2013.07.136
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.38 Å)
Structure validation

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