6P9D

Crystal Structure of Pseudomonas aeruginosa D-Arginine Dehydrogenase Y249F variant with FAD - Yellow fraction

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-11
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	60.100, 74.030, 77.190
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.010 - 1.329
R-factor	0.1329
Rwork	0.131
R-free	0.16210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3nye
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.950	1.377
High resolution limit [Å]	1.329	1.329
Rmerge	0.020	0.200
Number of reflections	79369	7650
<I/σ(I)>	17.19	3.6
Completeness [%]	99.4	96.96
Redundancy	2	2
CC(1/2)	0.999	0.882

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	298	0.05 M Tris-Cl pH 7.0-7.3, 10% glycerol, and 12-13% (w/v) PEG 3350, 5-10% PEG 6000