2HW5

The crystal structure of human enoyl-coenzyme A (CoA) hydratase short chain 1, ECHS1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	CCD
Collection date	2006-07-12
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9791
Spacegroup name	P 21 21 21
Unit cell lengths	91.554, 97.344, 231.796
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.600 - 2.550
R-factor	0.21614
Rwork	0.214
R-free	0.25165
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1dub
RMSD bond length	0.009
RMSD bond angle	1.116
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.640
High resolution limit [Å]	2.550	2.550
Number of reflections	66696
Completeness [%]	97.8	99.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	293	0.2M sodium formate, 0.1M Bis-Tris propane, 20 % PEG3350, 10 % Ethylene Glycol, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K