2GVX

Structure of diisopropyl fluorophosphatase (DFPase), mutant D229N / N175D

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MPG/DESY, HAMBURG BEAMLINE BW6
Synchrotron site	MPG/DESY, HAMBURG
Beamline	BW6
Temperature [K]	100
Detector technology	CCD
Collection date	2005-06-16
Detector	MAR CCD 165 mm
Wavelength(s)	1.05
Spacegroup name	P 21 21 21
Unit cell lengths	42.600, 82.700, 86.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.350 - 2.000
R-factor	0.216
Rwork	0.216
R-free	0.25700
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	MOSFLM
Phasing software	CNS
Refinement software	CNS (1.1)

Data quality characteristics

	Overall
Low resolution limit [Å]	41.350
High resolution limit [Å]	2.000
Number of reflections	21387
Completeness [%]	100.0

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	PEG 4000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K