6AJW

Crystal structure of BRD4 in complex with DMSO (Cocktail No. 4)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	100
Detector technology	CCD
Collection date	2016-06-18
Detector	ADSC QUANTUM 315r
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	33.407, 47.152, 78.316
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.259 - 1.401
R-factor	0.1929
Rwork	0.191
R-free	0.22810
RMSD bond length	0.005
RMSD bond angle	0.769
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	PHENIX ((1.12-2829_1069: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.200	1.450
High resolution limit [Å]	1.400	1.400
Rpim	0.019	0.267
Number of reflections	24881
<I/σ(I)>	19.8
Completeness [%]	99.2
Redundancy	4.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	4M sodium formate, 0.1M tris-HCl pH 8