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3MSL:
Fragment Based Discovery and Optimisation of BACE-1 Inhibitors
PDB ID:
3MSL
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MMDB ID:
83363
PDB Deposition Date:
2010/4/29
Updated in MMDB:
2023/09
Experimental Method:
x-ray diffraction
Resolution:
2.4 Å
Source Organism:
Homo sapiens
Similar Structures:
VAST+
Download sequence data
Biological Unit for 3MSL: monomeric; determined by author and by software (PISA)
Molecular Components in 3MSL
Label
Count
Molecule
Protein (1 molecule)
A
1
Beta-secretase 1
(Gene symbol:
BACE1
)
Chemicals and Non-standard biopolymers (3 molecules)
1
2
IODIDE ION
2
1
(3S)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)-N-(cyclohexylmethyl)pentanamide
* Click molecule labels to explore molecular sequence information.
Citing MMDB
Madej T, Lanczycki CJ, Zhang D, Thiessen PA, Geer RC, Marchler-Bauer A, Bryant SH.
"
MMDB and VAST+: tracking structural similarities between macromolecular complexes.
Nucleic Acids Res. 2014 Jan; 42(Database issue)
:D297-303