Raw diffraction images of the first bromodomain of human BRD4 in complex with (+)-JD1

Raw diffraction images of the first bromodomain of human BRD4 in complex with (+)-JD1, an Organometallic BET Bromodomain Inhibitor. The final structure is deposited in the Protein Data Bank under accession code 6SE4.

The structure is part of the following publication:

Hassell-Hart, S., Runcie, A., Krojer, T., Doyle, J., Lineham, E., Ocasio, C.A., Neto, B.A.D., Fedorov, O., Marsh, G., Maple, H., et al. (2019). Synthesis and Biological Investigation of (+)-JD1, an Organometallic BET Bromodomain Inhibitor. Organometallics. doi: 10.1021/acs.organomet.9b00750.

Additional information:

dataset: BRD4A-JD1_i03
beamline: Diamond Light Source I03
visit:  mx19301-7
date: 25-11-2018
Flux: 2.03e+11
Ω Start: 0.0°
Ω Osc: 0.15°
Ω Overlap: 0°
No. Images: 1200
Resolution: 1.50Å
Wavelength: 0.9762Å
Exposure: 0.030s
Transmission: 100.00%
Beamsize: 80x20μm

datasets: BRD4A-JD1_i04
beamline: Diamond Light Source I04
visit:  mx19301-9
date: 08-12-2018
Flux: 6.62e+11
Ω Start: 0.0°
Ω Osc: 0.50°
Ω Overlap: 0°
No. Images: 720
Resolution: 2.30Å
Wavelength: 1.7384Å
Exposure: 0.050s
Transmission: 100.00%
Beamsize: 32x20μm

Additionally, a cif file containing refinement restraints and a png file for the ligand JD1 is included.