4RC8

Crystal structure of cyanobacterial aldehyde-deformylating oxygenase bound with fatty acid

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-17A
Synchrotron site	Photon Factory
Beamline	BL-17A
Temperature [K]	100
Detector technology	CCD
Collection date	2013-06-18
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.98
Spacegroup name	P 21 21 21
Unit cell lengths	61.628, 61.984, 124.781
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.703 - 1.710
R-factor	0.189
Rwork	0.189
R-free	0.21200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4quw
RMSD bond length	0.009
RMSD bond angle	1.018
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0049)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.740
High resolution limit [Å]	1.710	1.710
Number of reflections	52286
Completeness [%]	99.8	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.1	291	0.2M L-proline, 0.1M Hepes pH 7.1, 25%(w/v) PEG1500, VAPOR DIFFUSION, SITTING DROP, temperature 291K