2G0W

CRYSTAL STRUCTURE OF A PUTATIVE SUGAR ISOMERASE (LMO2234) FROM LISTERIA MONOCYTOGENES AT 1.70 A RESOLUTION

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.2
Synchrotron site	ALS
Beamline	8.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2005-12-15
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9999, 0.9797
Spacegroup name	P 1 21 1
Unit cell lengths	62.832, 61.249, 70.428
Unit cell angles	90.00, 91.10, 90.00

Refinement procedure

Resolution	28.890 - 1.700
R-factor	0.191
Rwork	0.189
R-free	0.23800
Structure solution method	MAD
RMSD bond length	0.018
RMSD bond angle	1.640
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	SHELX
Refinement software	REFMAC (5.2.0005)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	28.894	28.890	1.740
High resolution limit [Å]	1.700	7.600	1.700
Rmerge	0.098	0.025	0.827
Total number of observations		2428	9608
Number of reflections	58181	695	3793
<I/σ(I)>	6.8	23.2	0.9
Completeness [%]	98.8	98.3	88.4
Redundancy	3.5	3.5	2.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP, NANODROP	8	277	25.0% PEG-3350, 0.2M MAGNESIUM ACETATE, 0.1M TRIS, pH 8.0, VAPOR DIFFUSION, SITTING DROP, NANODROP, temperature 277K