2CVQ

Crystal structure of NAD(H)-dependent malate dehydrogenase complexed with NADPH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	CCD
Collection date	2005-02-06
Detector	ADSC QUANTUM 210
Wavelength(s)	0.978
Spacegroup name	P 21 21 21
Unit cell lengths	70.290, 85.160, 118.070
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.060 - 2.080
R-factor	0.208
Rwork	0.208
R-free	0.24700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	Malate Dehydrogenase
RMSD bond length	0.005
RMSD bond angle	1.200
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	CCP4
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	69.070	2.210
High resolution limit [Å]	2.080	2.080
Number of reflections	43032
Completeness [%]	90.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	PEG4000, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K