7USH

BRD2-BD2 in complex with SF2523

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	100
Detector technology	CCD
Collection date	2022-02-19
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9787
Spacegroup name	P 21 21 2
Unit cell lengths	52.345, 71.732, 32.096
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.590 - 1.270
R-factor	0.1684
Rwork	0.167
R-free	0.19130
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6e6j
Data reduction software	HKL-2000
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.19.1_4122)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.590	1.315
High resolution limit [Å]	1.270	1.270
Rmerge	0.111
Rpim	0.041
Number of reflections	32349	2972
<I/σ(I)>	28.8
Completeness [%]	98.8
Redundancy	6.8
CC(1/2)	0.990	0.699

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	289.15	0.1 M Bis-Tris pH 6.5, 16 % PEG 3350