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6F6C

R2-like ligand-binding oxidase V72A mutant with aerobically reconstituted Mn/Fe cofactor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyPIXEL
Collection date2015-07-03
DetectorDECTRIS PILATUS 6M-F
Wavelength(s)0.978
Spacegroup nameC 1 2 1
Unit cell lengths162.462, 55.818, 69.741
Unit cell angles90.00, 114.09, 90.00
Refinement procedure
Resolution43.574 - 1.766
R-factor0.1817
Rwork0.179
R-free0.22260
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4hr0
RMSD bond length0.016
RMSD bond angle1.041
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX ((1.10.1_2155: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.870
High resolution limit [Å]1.7661.766
Rmerge0.0450.782
Rmeas0.0540.936
Number of reflections536337702
<I/σ(I)>13.71.2
Completeness [%]95.285.1
Redundancy3.33
CC(1/2)0.9990.725
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.929520% (W/V) PEG 1500, 0.1 M HEPES-NA PH 6.9, streak-seeded with crystals of the wild-type protein

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