9S1G

Crystal structure of Aurora-A bound to DBL6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-10-01
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9537
Spacegroup name	P 21 21 21
Unit cell lengths	54.735, 75.483, 87.736
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	57.220 - 2.355
Rwork	0.197
R-free	0.25850
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.947
Data reduction software	autoPROC
Data scaling software	STARANISO
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	57.220	2.520
High resolution limit [Å]	2.355	2.360
Number of reflections	12251	613
<I/σ(I)>	28.2
Completeness [%]	78.5
Redundancy	8.3
CC(1/2)	1.000	1.000

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.8% Alkaloids, 0.12M Ethyleneglycol, 0.1M Buffer system 3 pH 8.5, 30% Precipitant mix 1