5UV0

Crystal Structure of (+)-Limonene Synthase from Citrus sinensis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.2
Synchrotron site	ALS
Beamline	8.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2014-10-30
Detector	ADSC QUANTUM 315
Wavelength(s)	1.0
Spacegroup name	P 41 21 2
Unit cell lengths	85.790, 85.790, 216.350
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.992 - 2.300
R-factor	0.192
Rwork	0.190
R-free	0.22870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ong
RMSD bond length	0.007
RMSD bond angle	0.819
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (dev_2294)

Data quality characteristics

	Overall
Low resolution limit [Å]	20.000
High resolution limit [Å]	2.300
Rmerge	0.100
Number of reflections	36820
<I/σ(I)>	17.2
Completeness [%]	99.8
Redundancy	20.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	296	16% PEG8000, 100 mM Tris pH 7.5, 350 mM sodium tartrate