4DBZ

Crystal Structure of V151L Actinorhodin Polyketide Ketoreductase with NADPH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.2
Synchrotron site	ALS
Beamline	8.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2009-02-25
Detector	ADSC QUANTUM 315
Wavelength(s)	0.99980
Spacegroup name	P 32 2 1
Unit cell lengths	102.934, 102.934, 121.844
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.419 - 2.643
R-factor	0.1807
Rwork	0.179
R-free	0.21800
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.132
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	CCP4
Refinement software	PHENIX ((phenix.refine: 1.7_650))

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.640
Number of reflections	21581

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	9	298	0.1 M Tris-Cl, 1.8 M Na malonate, pH 9.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K