5MCO: CRYSTAL STRUCTURE OF BACE-1 IN COMPLEX WITH ACTIVE SITE INHIBITOR GRL-8234 AND EXOSITE PEPTIDE

PDB ID: 5MCODownload
MMDB ID: 154744
PDB Deposition Date: 2016/11/10
Updated in MMDB: 2018/12
Experimental Method:
x-ray diffraction
Resolution: 2.49  Å
Source Organism:
Similar Structures:
Biological Unit for 5MCO: dimeric; determined by author and by software (PISA)
Molecular Components in 5MCO
Label Count Molecule
Proteins (2 molecules)
1
Beta-secretase 1
(Gene symbol: BACE1)
Molecule annotation
1
Bace-1 Exosite Peptide
Molecule annotation
Chemical and Non-standard biopolymers (1 molecule)
1
1
N-{(1S,2R)-1-benzyl-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl}-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamideN-{(1S,2R)-1-benzyl-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl}-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide
* 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