5XD8

Crystal structure analysis of 3,6-anhydro-L-galactonate cycloisomerase

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	2012-07-10
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97934
Spacegroup name	P 21 21 21
Unit cell lengths	84.487, 90.350, 104.019
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.139 - 2.505
R-factor	0.2136
Rwork	0.209
R-free	0.27680
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ovl
RMSD bond length	0.009
RMSD bond angle	1.190
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (1.9_1692)
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.500
Number of reflections	262988
<I/σ(I)>	43.1
Completeness [%]	99.0
Redundancy	9.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	0.2 M magnesium chloride hexahydrate, 0.2 M Bis/Tris (pH 6.5) and 25% (w/v) polyethylene glycol 3,350