3UQU
Crystal structure of BACE1 with its inhibitor
Summary for 3UQU
Entry DOI | 10.2210/pdb3uqu/pdb |
Related | 3UQP 3UQR 3UQW 3UQX 4DV9 4DVF |
Descriptor | Beta-secretase 1, N-[(1R)-1-(4-fluorophenyl)ethyl]-N'-[(2S,3S)-3-hydroxy-1-phenyl-4-(1H-pyrazol-1-yl)butan-2-yl]-5-[methyl(methylsulfonyl)amino]benzene-1,3-dicarboxamide, SULFATE ION, ... (6 entities in total) |
Functional Keywords | hydrolase, beta-secretase, bace1, memapsin 2, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Homo sapiens (human) |
Cellular location | Membrane; Single-pass type I membrane protein: P56817 |
Total number of polymer chains | 1 |
Total formula weight | 49274.37 |
Authors | Chen, T.T.,Chen, W.Y.,Xu, Y.C. (deposition date: 2011-11-21, release date: 2012-11-21, Last modification date: 2023-11-08) |
Primary citation | Xu, Y.C.,Chen, W.Y.,Chen, T.T. Flexibility of the Flap in the Active Site of BACE1 as Revealed by Crystal Structures and MD simulations to be published, |
Experimental method | X-RAY DIFFRACTION (1.7 Å) |
Structure validation
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