2ZWU

Crystal Structure of Camphor Soaked Ferric Cytochrome P450cam

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	100
Detector technology	CCD
Collection date	2008-04-22
Detector	Bruker DIP-6040
Wavelength(s)	0.7
Spacegroup name	P 43 21 2
Unit cell lengths	63.608, 63.608, 250.389
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.900 - 1.300
R-factor	0.16644
Rwork	0.166
R-free	0.18386
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2cpp
RMSD bond length	0.010
RMSD bond angle	1.500
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP (9.4.09)
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.900	1.350
High resolution limit [Å]	1.300	1.300
Rmerge	0.075	0.407
Number of reflections	125182
<I/σ(I)>	34.4	4.9
Completeness [%]	98.6	98.9
Redundancy	4.9	5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.4	298	11-14% PEG 4000, 50mM Tris-HCl, 250mM KCl, 1mM d-camphor, 10mM dithioerythritol(DTE); After crystallization, soaked camphor saturated buffer for 2 days, pH 7.4, VAPOR DIFFUSION, SITTING DROP, temperature 298K