1GEE

Crystal structure of glucose dehydrogenase mutant Q252L complexed with NAD+

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-18B
Synchrotron site	Photon Factory
Beamline	BL-18B
Temperature [K]	288
Detector technology	DIFFRACTOMETER
Collection date	1999-11-28
Detector	WEISSENBERG
Wavelength(s)	1.0000
Spacegroup name	C 1 2 1
Unit cell lengths	120.528, 66.601, 119.296
Unit cell angles	90.00, 93.14, 90.00

Refinement procedure

Resolution	39.710 - 1.600
Rwork	0.195
R-free	0.20700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1gco
RMSD bond length	0.005
RMSD bond angle	1.200
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (0.9)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	100.000	1.660
High resolution limit [Å]	1.600	1.600
Rmerge	0.063	0.415
Number of reflections	318004
<I/σ(I)>	23.2
Completeness [%]	86.5	73.8
Redundancy	2.95	2.83

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293	sodium phosphate, PEG2000, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K