4G3R

Crystal Structure of Nitrosyl Cytochrome P450cam

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	70
Detector technology	CCD
Collection date	2012-01-11
Detector	RIGAKU SATURN 944+
Wavelength(s)	1.54
Spacegroup name	P 1 21 1
Unit cell lengths	67.553, 62.269, 95.490
Unit cell angles	90.00, 90.06, 90.00

Refinement procedure

Resolution	33.100 - 2.200
R-factor	0.193
Rwork	0.190
R-free	0.24990
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.011
RMSD bond angle	1.064
Data reduction software	d*TREK
Data scaling software	d*TREK
Refinement software	PHENIX ((phenix.refine: 1.8_1069))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	33.100	33.100	2.280
High resolution limit [Å]	2.200	4.740	2.200
Number of reflections	39581
Completeness [%]	97.6	99.3	92.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.4	298	50mM Tris-HCl pH 7.4, 26-32% PEG 4000, 250mM KCl, 1mM D-Camphor, VAPOR DIFFUSION, HANGING DROP, temperature 298K