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4RNU

G303 Circular Permutation of Old Yellow Enzyme

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 22-BM
Synchrotron siteAPS
Beamline22-BM
Temperature [K]100
Detector technologyCCD
Collection date2013-03-25
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)1.00000
Spacegroup nameP 1
Unit cell lengths45.662, 87.642, 113.572
Unit cell angles69.32, 82.56, 90.02
Refinement procedure
Resolution38.780 - 2.677
R-factor0.2483
Rwork0.247
R-free0.28300
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1oya
RMSD bond length0.002
RMSD bond angle0.502
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX
Refinement softwarePHENIX ((phenix.refine: 1.8.2_1309))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]38.7802.790
High resolution limit [Å]2.6772.677
Rmerge0.1070.829
Number of reflections42123
<I/σ(I)>13.81.9
Completeness [%]92.092.5
Redundancy65.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.528918% PEG 3350, 0.2 M MgCl2, 0.25% glucoside, 0.1 M HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K

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