4WP7: Structure of human ALDH1A1 with inhibitor CM026

PDB ID: 4WP7Download
MMDB ID: 126944
PDB Deposition Date: 2014/10/17
Updated in MMDB: 2019/12
Experimental Method:
x-ray diffraction
Resolution: 1.8  Å
Source Organism:
Similar Structures:
Biological Unit for 4WP7: tetrameric; determined by author and by software (PISA)
Molecular Components in 4WP7
Label Count Molecule
Proteins (4 molecules)
4
Retinal Dehydrogenase 1
(Gene symbol: ALDH1A1)
Molecule annotation
Chemicals and Non-standard biopolymers (8 molecules)
1
4
8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
2
4
CHLORIDE IONCHLORIDE ION
* 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