7USG

BRD2-BD2 in complex with MDP5

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2021-07-17
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9787
Spacegroup name	P 21 21 2
Unit cell lengths	52.560, 72.277, 32.213
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.600 - 1.200
R-factor	0.1783
Rwork	0.177
R-free	0.19730
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]	19.600	1.243
High resolution limit [Å]	1.200	1.200
Rmerge	0.106
Rpim	0.039
Number of reflections	35996	3501
<I/σ(I)>	28.7
Completeness [%]	91.8
Redundancy	6.7
CC(1/2)	0.991	0.762

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298.15	0.1 M Bis-Tris pH 6.5, 16 % W/V PEG 3350