6ULS

BRD4-BD1 in complex with the a diacetylated-E2F1 peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-30
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.953700
Spacegroup name	P 21 21 21
Unit cell lengths	48.309, 50.350, 54.246
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.900 - 1.500
R-factor	0.172
Rwork	0.170
R-free	0.20430
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4lyi
RMSD bond length	0.008
RMSD bond angle	0.977
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.310	1.530
High resolution limit [Å]	1.500	1.500
Number of reflections	21857	1070
<I/σ(I)>	32.5
Completeness [%]	100.0
Redundancy	12.8
CC(1/2)	0.999	0.982

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	291	0.1 M MMT pH 7.0, 25% w/v PEG 1500