9ET8

CDK2-cyclin A in complex with FragLite 5

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-02-09
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.89842
Spacegroup name	P 21 21 21
Unit cell lengths	74.171, 133.268, 147.371
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	99.041 - 2.310
Rwork	0.225
R-free	0.24220
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.646
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	99.041	2.370
High resolution limit [Å]	2.310	2.310
Rmerge	0.140	1.389
Number of reflections	64500	4491
<I/σ(I)>	11.3	1.6
Completeness [%]	99.4	100
Redundancy	13.5	13.3
CC(1/2)	0.998	0.827

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	277	Protein at 10 mg/ml. 0.6 to 0.8 M KCl, 0.9 to 1.2 M (NH4)2SO4, and 100 mM HEPES pH 7.0