4O9C

Crystal structure of Beta-ketothiolase (PhaA) from Ralstonia eutropha H16

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2013-09-15
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97954
Spacegroup name	P 1 21 1
Unit cell lengths	102.092, 157.438, 114.867
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	102.090 - 2.000
R-factor	0.17518
Rwork	0.173
R-free	0.21324
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.019
RMSD bond angle	1.944
Data reduction software	DENZO
Data scaling software	SCALEPACK
Refinement software	REFMAC (5.7.0032)

Data quality characteristics

	Overall
Low resolution limit [Å]	114.870
High resolution limit [Å]	2.000
Number of reflections	238329

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	hanging drop	7.5	295	25% PEG 3350, HEPES, 0.2M Ammonium sulfate, pH 7.5, hanging drop, temperature 295K