6YI9

Crystal structure of the rat cytosolic PCK1, acetylated on Lys244

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-04-20
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97
Spacegroup name	P 21 21 21
Unit cell lengths	60.384, 85.225, 119.669
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.950 - 1.750
R-factor	0.17201
Rwork	0.170
R-free	0.21151
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2qf2
RMSD bond length	0.012
RMSD bond angle	1.575
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.8.0222)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	1.840
High resolution limit [Å]	1.750	1.750
Rmerge	0.091
Number of reflections	55039	9080
<I/σ(I)>	13.2
Completeness [%]	87.3
Redundancy	5.7
CC(1/2)	0.997	0.874

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	PEG 3350 magnesium formate HEPES pH 8 NaF