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1XES

Crystal structure of stilbene synthase from Pinus sylvestris

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Temperature [K]100
Detector technologyCCD
DetectorADSC QUANTUM 4
Spacegroup nameP 1 21 1
Unit cell lengths54.366, 111.373, 131.695
Unit cell angles90.00, 93.05, 90.00
Refinement procedure
Resolution19.950 - 1.700
R-factor0.202
Rwork0.202
R-free0.22500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)PDB ID 1CGZ
RMSD bond length0.005
RMSD bond angle1.300
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 Overall
Low resolution limit [Å]19.950
High resolution limit [Å]1.700
Number of reflections171176
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP3.8292PEG 4000, citric acid, pH 3.8, VAPOR DIFFUSION, HANGING DROP, temperature 292K

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