3CAX

Crystal structure of uncharacterized protein PF0695

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4C
Synchrotron site	NSLS
Beamline	X4C
Temperature [K]	100
Detector technology	CCD
Collection date	2008-02-01
Detector	MAR CCD 165 mm
Wavelength(s)	0.9793
Spacegroup name	I 2 2 2
Unit cell lengths	59.840, 119.534, 181.910
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.690 - 2.430
R-factor	0.188
Rwork	0.185
R-free	0.22600
Structure solution method	SAD
RMSD bond length	0.013
RMSD bond angle	1.290
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SHELXD
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.490
High resolution limit [Å]	2.430	2.430
Rmerge	0.107	0.744
Number of reflections	24050
<I/σ(I)>	7.7	2.74
Completeness [%]	99.0	98.6
Redundancy	12	12.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	298	0.2M Ammonium(tri-)citrate pH 7.0, 20% PEG 3350, VAPOR DIFFUSION, SITTING DROP, temperature 298K
1	VAPOR DIFFUSION, SITTING DROP	7	298	0.2M Ammonium(tri-)citrate pH 7.0, 20% PEG 3350, VAPOR DIFFUSION, SITTING DROP, temperature 298K
1	VAPOR DIFFUSION, SITTING DROP	7	298	0.2M Ammonium(tri-)citrate pH 7.0, 20% PEG 3350, VAPOR DIFFUSION, SITTING DROP, temperature 298K