3K1Z

Crystal Structure of Human Haloacid Dehalogenase-like Hydrolase Domain containing 3 (HDHD3)

Experimental procedure

Experimental method	SAD
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I02
Synchrotron site	Diamond
Beamline	I02
Temperature [K]	100
Detector technology	CCD
Collection date	2009-09-07
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9773, 0.9796
Spacegroup name	P 21 21 21
Unit cell lengths	51.625, 62.455, 79.665
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.320 - 1.550
R-factor	0.16935
Rwork	0.167
R-free	0.20688
Structure solution method	SAD
RMSD bond length	0.013
RMSD bond angle	1.443
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	SHELXCD
Refinement software	REFMAC (5.5.0089)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.320	1.630
High resolution limit [Å]	1.550	1.550
Rmerge	0.060	0.552
Number of reflections	37908
<I/σ(I)>	11.5	2
Completeness [%]	99.4	98.7
Redundancy	4.1	3.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	0.49M NaH2PO4, 0.91M K2HPO4, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K