4H7P

Crystal structure of a putative Cytosolic malate dehydrogenase from Leishmania major Friedlin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	CCD
Collection date	2012-07-28
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0000
Spacegroup name	P 1 21 1
Unit cell lengths	64.580, 65.660, 77.650
Unit cell angles	90.00, 110.11, 90.00

Refinement procedure

Resolution	28.920 - 1.300
R-factor	0.1534
Rwork	0.152
R-free	0.17850
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1iz9
RMSD bond length	0.013
RMSD bond angle	1.656
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (2.5.1)
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.330
High resolution limit [Å]	1.300	5.810	1.300
Rmerge	0.047	0.029	0.336
Number of reflections	146529	1567	10351
<I/σ(I)>	24.71	59.37	4.11
Completeness [%]	97.9	88.6	94
Redundancy	9.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	290	EmeraldBio JCSG+ screen h7: 25% PEG 3350, 200mM ammonium sulphate, 100mM BisTris pH 5.5; LemaA.01212.a.A1.P001468 at 20mg/ml, VAPOR DIFFUSION, SITTING DROP, temperature 290K