4KVQ

Crystal Structure of Prochlorococcus marinus aldehyde-deformylating oxygenase wild type with palmitic acid bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2011-05-06
Detector	DECTRIS PILATUS 6M
Spacegroup name	P 43 21 2
Unit cell lengths	77.030, 77.030, 115.860
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.548 - 1.842
R-factor	0.1799
Rwork	0.178
R-free	0.21670
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.981
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.2_1309))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.300	1.890
High resolution limit [Å]	1.840	1.840
Number of reflections	30929
Completeness [%]	100.0	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.4	277	0.3M sodium acetate, 0.1M Tris, 10% w/v PEG 8K,10% w/v PEG 1K 200nl plus 200nl drops, VAPOR DIFFUSION, SITTING DROP, temperature 277K, pH 7.4