6SWO

C-TERMINAL BROMODOMAIN OF HUMAN BRD2 WITH iBET-BD1 (GSK778)

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	CCD
Collection date	2018-12-13
Detector	RIGAKU
Wavelength(s)	1.54178
Spacegroup name	P 21 21 2
Unit cell lengths	71.974, 52.713, 32.038
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	26.260 - 1.601
Rwork	0.167
R-free	0.19130
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.004
RMSD bond angle	1.185
Data reduction software	XDS
Data scaling software	Aimless
Refinement software	REFMAC (5.8.0253)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	26.260	1.690
High resolution limit [Å]	1.600	1.600
Number of reflections	15926	1752
<I/σ(I)>	21.3	3.7
Completeness [%]	95.6
Redundancy	2.6
CC(1/2)	0.991	0.603

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	30% PEG 300, 0.1M MES buffer