6NQ9

Crystal structure of YetJ mutant from Bacillus Subtilis - D195E

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X25
Synchrotron site	NSLS
Beamline	X25
Temperature [K]	100
Detector technology	CCD
Collection date	2014-09-30
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.1
Spacegroup name	C 1 2 1
Unit cell lengths	217.333, 118.203, 51.891
Unit cell angles	90.00, 93.23, 90.00

Refinement procedure

Resolution	39.960 - 3.100
R-factor	0.2486
Rwork	0.247
R-free	0.27550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4pgr
RMSD bond length	0.002
RMSD bond angle	0.409
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.960	3.300
High resolution limit [Å]	3.100	3.100
Number of reflections	92561
<I/σ(I)>	6
Completeness [%]	99.8
Redundancy	3.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	298	0.1 M ADA, pH 7.0, 30% PEG 600