8OJ9

Arabidopsis thaliana Phosphoenolpyruvate carboxylase PPC1 free form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-10-07
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.981
Spacegroup name	I 41 2 2
Unit cell lengths	244.350, 244.350, 397.070
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.504 - 3.246
R-factor	0.229578194941
Rwork	0.228
R-free	0.26405
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.782
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.505	3.440
High resolution limit [Å]	3.245	3.250
Rmerge	0.303	2.840
Number of reflections	94348	14811
<I/σ(I)>	9.21
Completeness [%]	99.7	98.6
Redundancy	22.4	22.47
CC(1/2)	0.999	0.730

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	6.5	293	0.05 M Cesium chloride, 0.1 M MES monohydrate pH 6.5, 30% v/v Jeffamine M-600