7RJN

Crystal structure of human bromodomain containing protein 3 (BRD3) in complex with BCLTF1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-03-31
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.92
Spacegroup name	P 21 21 21
Unit cell lengths	42.729, 54.793, 122.242
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 1.950
R-factor	0.1852
Rwork	0.183
R-free	0.23400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6qju
Data reduction software	XDS
Data scaling software	Aimless (0.7.4)
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	29.490	29.490	2.000
High resolution limit [Å]	1.950	8.940	1.950
Rmerge	0.133	0.071	0.678
Rmeas	0.139	0.075	0.703
Rpim	0.038	0.024	0.188
Total number of observations	285809	3023	20457
Number of reflections	21679	269	1472
<I/σ(I)>	14.3	23	4.6
Completeness [%]	100.0	97.2	99.9
Redundancy	13.2	11.2	13.9
CC(1/2)	0.997	0.997	0.948

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.6	292	0.2 M ammonium acetate, 0.1 M sodium acetate trihydrate, 30% w/v PEG4000