4EJ0

Crystal structure of ADP-L-glycero-D-manno-heptose-6-epimerase from Burkholderia thailandensis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	CCD
Collection date	2011-07-17
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.95369
Spacegroup name	P 21 21 21
Unit cell lengths	158.317, 160.923, 169.628
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.971 - 2.609
R-factor	0.1878
Rwork	0.185
R-free	0.24100
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.135
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	EPMR
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.020
High resolution limit [Å]	2.609	2.610
Number of reflections	131360
Completeness [%]	83.7	99.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	296	35% PEG 200, 0.1M Bis-Tris pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 296K