1R31

HMG-CoA reductase from Pseudomonas mevalonii complexed with HMG-CoA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE F2
Synchrotron site	CHESS
Beamline	F2
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	1996-01-07
Detector	FUJI
Wavelength(s)	1.050
Spacegroup name	I 41 3 2
Unit cell lengths	227.369, 227.369, 227.369
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.100
R-factor	0.2221564
Rwork	0.220
R-free	0.24100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	Native HMGR model at 3.0A
RMSD bond length	0.010
RMSD bond angle	1.400
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS (1.1)

Data quality characteristics

	Overall
Low resolution limit [Å]	30.000
High resolution limit [Å]	2.100
Number of reflections	53328

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.7	298	1.2 M ammonium sulfate, 100 mM ADA buffer at pH 6.7, microseeding, VAPOR DIFFUSION, SITTING DROP, temperature 298K