8SB6

Structure of human BRD2-BD1 bound to a histone H4 acetyl-methyllysine peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	OTHER
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-03-24
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.97918
Spacegroup name	C 1 2 1
Unit cell lengths	115.378, 55.819, 68.006
Unit cell angles	90.00, 94.41, 90.00

Refinement procedure

Resolution	67.800 - 1.800
R-factor	0.1818
Rwork	0.181
R-free	0.20410
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6ony
RMSD bond length	0.015
RMSD bond angle	1.174
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.19.1_4122+SVN)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	67.800	1.810
High resolution limit [Å]	1.780	1.780
Number of reflections	41240	2265
<I/σ(I)>	11.3
Completeness [%]	99.2
Redundancy	3.4
CC(1/2)	0.998	0.338

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M MES, pH 6.7, 20-25% PEG5000 MME, 0.2 M ammonium sulfate