4O0L

Crystal structure of NADPH-Dependent 3-Quinuclidinone Reductase from Rhodotorula Rubra

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Detector technology	CCD
Collection date	2008-03-04
Detector	ADSC QUANTUM 315
Spacegroup name	P 41 21 2
Unit cell lengths	91.272, 91.272, 265.350
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 2.200
R-factor	0.1844
Rwork	0.182
R-free	0.22260
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1vl8
RMSD bond length	0.014
RMSD bond angle	1.517
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall
Low resolution limit [Å]	20.000
High resolution limit [Å]	2.200
Number of reflections	55859

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	10	278	100MM CHES, 30% PEG8000, 3% SUCROSE, pH 10.0, VAPOR DIFFUSION, SITTING DROP, temperature 278K