7XLL

Alanine racemase from Lactobacillus sakei Uonuma-1.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-12-04
Detector	DECTRIS PILATUS3 S 2M
Wavelength(s)	1.0
Spacegroup name	P 21 21 2
Unit cell lengths	107.730, 125.040, 56.640
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	62.520 - 1.760
R-factor	0.1664
Rwork	0.165
R-free	0.19880
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3e5p
RMSD bond length	0.006
RMSD bond angle	0.821
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	62.520	1.790
High resolution limit [Å]	1.760	1.760
Rmerge		0.650
Number of reflections	76568	4267
<I/σ(I)>	9.8	2.2
Completeness [%]	99.7	98.9
Redundancy	5.9
CC(1/2)	0.992	0.794

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	289	PEG 4000, Tris-HCl, sodium acetate