3LAO

Crystal Structure of Enoyl-CoA Hydratase from Pseudomonas aeruginosa PA01

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-BM
Synchrotron site	APS
Beamline	19-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2009-11-08
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.97921
Spacegroup name	P 21 21 21
Unit cell lengths	49.362, 101.616, 141.536
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.400 - 2.400
R-factor	0.177
Rwork	0.172
R-free	0.23900
Structure solution method	SAD
RMSD bond length	0.014
RMSD bond angle	1.531
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	HKL-3000
Refinement software	PHENIX ((phenix.refine: 1.5_2))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.400	2.440
High resolution limit [Å]	2.400	2.400
Number of reflections	28582
<I/σ(I)>	11.5	5.11
Completeness [%]	99.9	100
Redundancy	8.8	8.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.2 M Potassium sodium tartrate, tetrahydrate, 20 % w/v Polyehtlyene glycol 3,350, VAPOR DIFFUSION, SITTING DROP, temperature 277K