4KTI

Crystal Structure of C143A Xathomonas campestris OleA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2012-02-16
Detector	MAR scanner 300 mm plate
Wavelength(s)	1.03
Spacegroup name	P 21 21 21
Unit cell lengths	82.204, 85.379, 102.706
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.006 - 1.839
R-factor	0.1554
Rwork	0.153
R-free	0.19970
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.015
RMSD bond angle	1.546
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.880
High resolution limit [Å]	1.850	1.850
Rmerge	0.060	0.444
Number of reflections	57489
<I/σ(I)>	23.6	6.5
Completeness [%]	97.2	97.2
Redundancy	7.5	7.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.2	298	16% PEG 8000, 80 mM potassium phosphate dibasic, 100 mM sodium citrate pH 4.2, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K