6Z7F

C-TERMINAL BROMODOMAIN OF HUMAN BRD2 WITH N-(2-(1H-imidazol-4-yl)ethyl)-4-acetamido-3-(benzyloxy)benzamide

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	2014-09-30
Detector	RIGAKU SATURN A200
Wavelength(s)	1.54178
Spacegroup name	P 21 21 2
Unit cell lengths	71.718, 52.618, 32.017
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	26.309 - 1.605
Rwork	0.152
R-free	0.18000
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.003
RMSD bond angle	1.159
Data reduction software	XDS
Data scaling software	SCALA
Refinement software	REFMAC (5.8.0257)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	71.720	1.680
High resolution limit [Å]	1.600	1.600
Rmerge	0.021	0.105
Number of reflections	15744	1885
<I/σ(I)>	30	7.8
Completeness [%]	96.0	81.1
Redundancy	3	1.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	6.5	293	30% PEG300, 0.1M MES