6PXP

Human Casein Kinase 1 delta Site 2 mutant (K171E)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-04-11
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.03317
Spacegroup name	P 1 21 1
Unit cell lengths	50.060, 130.350, 51.650
Unit cell angles	90.00, 113.47, 90.00

Refinement procedure

Resolution	45.918 - 2.350
R-factor	0.2009
Rwork	0.199
R-free	0.24330
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5x17
RMSD bond length	0.009
RMSD bond angle	1.191
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.15.2_3472))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.380	2.430
High resolution limit [Å]	2.350	2.350
Rmerge	0.128	0.652
Rpim	0.077	0.404
Number of reflections	25271	2470
<I/σ(I)>	6.7	2.1
Completeness [%]	99.9
Redundancy	4.3	4.4
CC(1/2)	0.990	0.770

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	295	7.7 mg/mL Protein 0.05 M Sodium Acetate 0.35 M Ammonium Sulfate 17.5% PEG 3500