6FYO

X-RAY STRUCTURE OF CLK1-KD(148-484)/Cpd-2 AT 2.32A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-04-24
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.99998
Spacegroup name	P 1 21 1
Unit cell lengths	62.039, 49.511, 65.514
Unit cell angles	90.00, 117.55, 90.00

Refinement procedure

Resolution	19.810 - 2.320
R-factor	0.2043
Rwork	0.203
R-free	0.23350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5j1w
RMSD bond length	0.007
RMSD bond angle	0.948
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.810	2.380
High resolution limit [Å]	2.320	2.320
Rmerge	0.059	0.334
Rmeas	0.070	0.409
Number of reflections	15267
<I/σ(I)>	16.7	3.3
Completeness [%]	98.1	93.9
Redundancy	3.3	2.8
CC(1/2)	0.998	0.885

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	298	25% PEG3350,0.2M Ammonium Sulfate, 0.1M TRIS