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4YN9

YfiR mutant-C110S

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U
Synchrotron siteSSRF
BeamlineBL17U
Temperature [K]100
Detector technologyCCD
Collection date2015-01-24
DetectorADSC QUANTUM 315
Wavelength(s)0.97922
Spacegroup nameP 43 21 2
Unit cell lengths121.011, 121.011, 86.513
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution38.604 - 2.450
R-factor0.1908
Rwork0.189
R-free0.23450
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4yn7
RMSD bond length0.008
RMSD bond angle1.035
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX
Refinement softwarePHENIX ((phenix.refine: 1.9_1692))
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0002.490
High resolution limit [Å]2.4506.6502.450
Rmerge0.0690.0290.381
Total number of observations249982
Number of reflections23583
<I/σ(I)>13.4
Completeness [%]97.390.398
Redundancy10.69.410.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52970.1 M HEPES pH 7.5, 1.8 M Ammonium sulfate

246031

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