8UK5

Crystal structure of the bromodomain of human ATAD2B in complex with histone H4S1(ph)K5ac

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CMOS
Collection date	2020-07-12
Detector	RDI CMOS_8M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	41.080, 48.580, 83.320
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.370 - 1.400
Rwork	0.178
R-free	0.20230
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.865
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	31.370	1.450
High resolution limit [Å]	1.400	1.400
Number of reflections	33447	37316
<I/σ(I)>	28.93
Completeness [%]	99.5
Redundancy	11.9
CC(1/2)	1.000	0.873

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	277	0.2 M ammonium sulfate, 0.1 M BIS-TRIS (pH 5.5), 25% w/v PEG 3350