5VKT

Cinnamyl alcohol dehydrogenases (SbCAD4) from Sorghum bicolor (L.) Moench

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-10-02
Detector	ADSC QUANTUM 315r
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	55.597, 74.280, 97.288
Unit cell angles	90.00, 96.74, 90.00

Refinement procedure

Resolution	45.683 - 1.827
R-factor	0.1639
Rwork	0.163
R-free	0.18660
RMSD bond length	0.003
RMSD bond angle	0.568
Data scaling software	HKL-2000
Phasing software	HKL-3000
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	45.683
High resolution limit [Å]	1.827
Number of reflections	67962
<I/σ(I)>	9.2
Completeness [%]	97.4
Redundancy	1.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277.15	2% v/v Tacsimate pH 7.0, 5% v/v 2-Propanol, 0.1 M Imidazole pH 7.0, 8% w/v Polyethylene glycol 3350