3LHI

Crystal structure of Putative 6-phosphogluconolactonase(YP_207848.1) from Neisseria gonorrhoeae FA 1090 at 1.33 A resolution

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	CCD
Collection date	2009-11-06
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	0.91837,0.97951
Spacegroup name	P 32 2 1
Unit cell lengths	63.237, 63.237, 106.920
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	27.382 - 1.330
R-factor	0.133
Rwork	0.132
R-free	0.16100
Structure solution method	MAD
RMSD bond length	0.017
RMSD bond angle	1.702
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SHELX
Refinement software	REFMAC (5.5.0102)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	27.382	27.382	1.380
High resolution limit [Å]	1.330	2.860	1.330
Rmerge	0.036	0.023	0.594
Number of reflections	52593	10997	6413
<I/σ(I)>	17.47	47.6	1.4
Completeness [%]	90.9	99.3	55.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.2	277	0.2000M NH4F, 20.0000% PEG-3350, No Buffer pH 6.2, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K