3ODK: Discovery Of Cell-Active Phenyl-Imidazole Pin1 Inhibitors By Structure-Guided Fragment Evolution

Pin1 is an emerging oncology target strongly implicated in Ras and ErbB2-mediated tumourigenesis. Pin1 isomerizes bonds linking phospho-serine/threonine moieties to proline enabling it to play a key role in proline-directed kinase signalling. Here we report a novel series of Pin1 inhibitors based on a phenyl imidazole acid core that contains sub-muM inhibitors. Compounds have been identified that block prostate cancer cell growth under conditions where Pin1 is essential.
PDB ID: 3ODKDownload
MMDB ID: 85800
PDB Deposition Date: 2010/8/11
Updated in MMDB: 2010/11
Experimental Method:
x-ray diffraction
Resolution: 2.3  Å
Source Organism:
Similar Structures:
Biological Unit for 3ODK: monomeric; determined by author
Molecular Components in 3ODK
Label Count Molecule
Protein (1 molecule)
Peptidyl-prolyl Cis-trans Isomerase Nima-interacting 1(Gene symbol: PIN1)
Molecule annotation
Chemicals (2 molecules)
* Click molecule labels to explore molecular sequence information.

Citing MMDB