1Y7T

Crystal structure of NAD(H)-depenent 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	2004-05-21
Detector	ADSC QUANTUM 210
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	70.120, 85.170, 117.930
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.400 - 1.650
R-factor	0.197
Rwork	0.197
R-free	0.20700
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	1.300
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]	36.400	1.750
High resolution limit [Å]	1.650	1.650
Rmerge	0.049	0.049
Number of reflections	85416
<I/σ(I)>		4.3
Completeness [%]	99.7	99.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	PEG 4000, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K