2F3E: Crystal Structure Of The Bace Complex With Axq093, A Macrocyclic Inhibitor

PDB ID: 2F3EDownload
MMDB ID: 40827
PDB Deposition Date: 2005/11/21
Updated in MMDB: 2017/10
Experimental Method:
x-ray diffraction
Resolution: 2.11  Å
Source Organism:
Similar Structures:
Biological Unit for 2F3E: monomeric; determined by author
Molecular Components in 2F3E
Label Count Molecule
Protein (1 molecule)
1
Beta-secretase 1
(Gene symbol: BACE1)
Molecule annotation
Chemical and Non-standard biopolymers (1 molecule)
1
1
{(E)-(3r,6s,9r)-3-[(1s,3r)-3-((S)-1 -Butylcarbamoyl-2-Methyl-Propylcarb Amoyl)-1-Hydroxy-Butyl]-6-Methyl-5,8-Dioxo-1,11-Dithia-4,7-Diaza-Cyclo Pentadec-13-En-9-Yl}-Carbamic Acid Tert-Butyl Ester{(E)-(3r,6s,9r)-3-[(1s,3r)-3-((S)-1 -Butylcarbamoyl-2-Methyl-Propylcarb Amoyl)-1-Hydroxy-Butyl]-6-Methyl-5,8-Dioxo-1,11-Dithia-4,7-Diaza-Cyclo Pentadec-13-En-9-Yl}-Carbamic Acid Tert-Butyl Ester
* 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