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3DOE

Complex of ARL2 and BART, Crystal Form 1

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-5A
Synchrotron sitePhoton Factory
BeamlineBL-5A
Temperature [K]95
Detector technologyCCD
Collection date2007-12-07
DetectorADSC QUANTUM 315
Wavelength(s)1.5596
Spacegroup nameP 1 21 1
Unit cell lengths57.827, 44.081, 66.495
Unit cell angles90.00, 111.46, 90.00
Refinement procedure
Resolution35.900 - 2.250
R-factor0.23168
Rwork0.230
R-free0.26123
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ksg
RMSD bond length0.008
RMSD bond angle1.327
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareCNS
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.330
High resolution limit [Å]2.2502.250
Rmerge0.0650.216
Number of reflections14727
<I/σ(I)>27.94
Completeness [%]97.783.7
Redundancy6.64.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP92770.1M bicine, 10% PEG 6000, 20mM hexammine cobalt (III) chloride, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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