7BJY

Crystal structure of the first bromodomain (BD1) of human BRDT bound to Ro3280

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-06-21
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9700
Spacegroup name	P 61 2 2
Unit cell lengths	57.040, 57.040, 407.870
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	42.254 - 2.220
R-factor	0.2174
Rwork	0.215
R-free	0.25550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7l73
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	42.254	42.254	2.280
High resolution limit [Å]	2.220	9.930	2.220
Rmerge	0.132	0.030	1.113
Rmeas	0.135	0.031	1.141
Total number of observations	441196
Number of reflections	20864	309	1501
<I/σ(I)>	19.24	45.17	3
Completeness [%]	99.9	98.7	100
Redundancy	21.146	16.249	20.266
CC(1/2)	1.000	1.000	0.831

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	0.2 M NaCl, 0.1 M Bis-Tris pH5.5, 25% w/v PEG 3,350