4TKQ

Native-SAD phasing for YetJ from Bacillus Subtilis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4A
Synchrotron site	NSLS
Beamline	X4A
Temperature [K]	100
Detector technology	CCD
Collection date	2012-11-09
Detector	ADSC QUANTUM 4r
Wavelength(s)	2.07
Spacegroup name	P 65 2 2
Unit cell lengths	61.869, 61.869, 288.401
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	39.257 - 2.803
R-factor	0.2225
Rwork	0.221
R-free	0.25980
Structure solution method	SAD
RMSD bond length	0.002
RMSD bond angle	0.604
Refinement software	PHENIX ((phenix.refine: 1.8_1069))

Data quality characteristics

	Overall
Low resolution limit [Å]	40.000
High resolution limit [Å]	2.000
Number of reflections	8784
<I/σ(I)>	56.8
Completeness [%]	98.9
Redundancy	535.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	277	30% PEG 600, 100 mM CaCl2, 100 mM Tris-HCl, pH 8.0