Fragment Screening

Download site of final models of X-ray fragment screening at Diamond’s XChem facility.  Each link is an archive of PDB models and some experimental information.  Full details available upon request (Frank von Delft, frank.vondelft[at]sgc.ox.ac.uk). 

We welcome any feedback, no matter how terse, on the usefulness of these structures;  collaboration ideas for follow-up chemistry are also welcome.

  • KDM4D/JMJD2D   View in WONKA
    Overall status: Complete         fragments (active site:10, "allosteric":28)  Last update: 24/02/2016
  • ATAD2    View in WONKA
    Overall status: Compchem ready   fragments (active site: 9, "allosteric":22)  Last update: 06/05/2016
  • KDM5B/JARID1B  View in WONKA
    Overall status: Compchem ready   fragments (active site:25, "allosteric": 9)  Last update: 23/05/2016
  • KDM3B/JMJD1B   View in WONKA
    Overall status: Compchem ready   fragments (active site: 3, "allosteric":15)  Last update: 23/05/2016
  • BRD1     View in WONKA
    Overall status: Complete         fragments (active site:38, "allosteric": 3)  Last update: 23/05/2016
  • NUTD22     View
    Overall status: Complete                                                      Last update: 02/03/2017
  • JMJD2DA     View
    Overall status: Complete                                                      Last update: 02/03/2017
  • BRD1A     View
    Overall status: Complete                                                      Last update: 02/03/2017
  • SP100A     View
    Overall status: Complete                                                      Last update: 02/03/2017
  • BAZ2BA     View
    Overall status: Complete                                                      Last update: 02/03/2017
glqxz9283 sfy39587stf02 mnesdcuix8
sfy39587stf03