5OU5

Crystal structure of maize chloroplastic photosynthetic NADP(+)-dependent malic enzyme

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-03-20
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.976254
Spacegroup name	I 21 21 21
Unit cell lengths	135.961, 147.155, 261.615
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.880 - 2.200
R-factor	0.1623
Rwork	0.160
R-free	0.21056
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.018
RMSD bond angle	1.837
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0131)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.880	2.279
High resolution limit [Å]	2.200	2.200
Rmerge	0.063	0.472
Number of reflections	132077	12943
<I/σ(I)>	18.67	3.51
Completeness [%]	100.0	99
Redundancy	5.9	6
CC(1/2)	0.999	0.906

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		285	0.1 M KCl, 0.1 M sodium citrate pH 5.5, 34 % (v/v) pentaerythritol-propylate (5/4 PO/OH)