4R1U

Crystal structure of Medicago truncatula cinnamoyl-CoA reductase

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	CCD
Detector	ADSC QUANTUM 4
Wavelength(s)	0.9792, 0.9184, 0.9794
Spacegroup name	P 21 21 21
Unit cell lengths	70.795, 96.821, 106.913
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.980 - 2.180
R-factor	0.2022
Rwork	0.198
R-free	0.24240
Structure solution method	MAD
RMSD bond length	0.008
RMSD bond angle	1.099
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SHARP
Refinement software	PHENIX (1.8.1_1168)

Data quality characteristics

	Overall
High resolution limit [Å]	2.180
Number of reflections	38353

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	277	21% (w/v) polyethylene glycol 8000, 0.2 M potassium acetate, 100 mM HEPES, and 2 mM DTT, pH 7.5, vapor diffusion, hanging drop, temperature 277K