3P3X

Crystal Structure of the Cytochrome P450 Monooxygenase AurH (nterm-AurH-I) from Streptomyces Thioluteus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.2
Synchrotron site	BESSY
Beamline	14.2
Temperature [K]	100
Detector technology	CCD
Collection date	2007-12-04
Detector	MAR CCD 165 mm
Wavelength(s)	0.91841
Spacegroup name	P 21 21 2
Unit cell lengths	129.330, 131.780, 53.230
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.300
R-factor	0.22783
Rwork	0.226
R-free	0.27957
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.319
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.5.0110)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.360
High resolution limit [Å]	2.300	2.300
Number of reflections	38128
Completeness [%]	92.3	90.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	0.1 M NaCl, 2.1M AS, 0.1 M HEPES pH=6.4-6.6, 10 mg/mL, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K