5EYK

CRYSTAL STRUCTURE OF AURORA B IN COMPLEX WITH BI 847325

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2009-09-11
Detector	PSI PILATUS 6M
Wavelength(s)	1.000
Spacegroup name	P 1 21 1
Unit cell lengths	46.140, 67.450, 116.760
Unit cell angles	90.00, 96.63, 90.00

Refinement procedure

Resolution	19.460 - 1.930
R-factor	0.2
Rwork	0.199
R-free	0.22200
RMSD bond length	0.009
RMSD bond angle	1.000
Data reduction software	XDS
Data scaling software	XSCALE
Refinement software	BUSTER (2.9.2)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	115.980	2.730	2.030
High resolution limit [Å]	1.930	2.490	1.930
Rmerge	0.058	0.115	0.401
Number of reflections	52056
<I/σ(I)>	13.8		2
Completeness [%]	96.7	98.1	90.6
Redundancy	3	3.4	1.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.2	293	PEG 3350, Bis-Tris