2W1C

Structure determination of Aurora Kinase in complex with inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-4
Synchrotron site	ESRF
Beamline	ID14-4
Temperature [K]	100
Detector technology	CCD
Detector	ADSC CCD
Spacegroup name	P 61 2 2
Unit cell lengths	82.864, 82.864, 168.193
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	54.590 - 3.240
R-factor	0.246
Rwork	0.244
R-free	0.28800
Structure solution method	OTHER
Starting model (for MR)	NONE
RMSD bond length	0.010
RMSD bond angle	1.315
Refinement software	REFMAC (5.4.0069A)

Data quality characteristics

	Overall
Low resolution limit [Å]	54.500
High resolution limit [Å]	3.240
Rmerge	0.060
Number of reflections	5301
<I/σ(I)>	3.4
Completeness [%]	94.7
Redundancy	3.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1