5V24: Structure-based drug design of novel ASK1 inhibitors using a fully integrated lead optimization strategy

PDB ID: 5V24Download
MMDB ID: 149411
PDB Deposition Date: 2017/3/2
Updated in MMDB: 2017/12
Experimental Method:
x-ray diffraction
Resolution: 2.5  Å
Source Organism:
Similar Structures:
Biological Unit for 5V24: monomeric; determined by author and by software (PISA)
Molecular Components in 5V24
Label Count Molecule
Protein (1 molecule)
1
Mitogen-activated Protein Kinase Kinase Kinase 5
(Gene symbol: MAP3K5)
Molecule annotation
Chemical and Non-standard biopolymers (1 molecule)
1
1
2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-N-(pyridin-2-yl)-1,3-thiazole-4-carboxamide2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-N-(pyridin-2-yl)-1,3-thiazole-4-carboxamide
* 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