4PGR

Crystal structure of YetJ from Bacillus Subtilis at pH 8

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	2012-11-09
Detector	MAR CCD 165 mm
Wavelength(s)	0.979
Spacegroup name	P 65 2 2
Unit cell lengths	61.547, 61.547, 289.563
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	39.219 - 1.950
R-factor	0.2078
Rwork	0.206
R-free	0.23430
Structure solution method	SAD
RMSD bond length	0.005
RMSD bond angle	0.831
Refinement software	PHENIX ((phenix.refine: 1.8_1069))

Data quality characteristics

	Overall
Low resolution limit [Å]	40.000
High resolution limit [Å]	1.950
Number of reflections	23957
<I/σ(I)>	14.3
Completeness [%]	97.2
Redundancy	13.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	30% PEG 600, 100 mM CaCl2, 100 mM Tris-HCl, pH 8.0