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4Q5P

Lysine-Ligated Yeast Iso-1 Cytochrome C

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X6A
Synchrotron siteNSLS
BeamlineX6A
Temperature [K]100
Detector technologyCCD
Collection date2013-10-10
DetectorADSC QUANTUM 270
Wavelength(s)1.0781
Spacegroup nameI 4 2 2
Unit cell lengths106.020, 106.020, 149.840
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.520 - 1.870
R-factor0.17386
Rwork0.172
R-free0.20367
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1yea
RMSD bond length0.009
RMSD bond angle1.228
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHENIX
Refinement softwareREFMAC (5.8.0103)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]19.5203.1901.970
High resolution limit [Å]1.8702.7801.870
Rmerge0.0720.0600.597
Number of reflections35544
<I/σ(I)>29.9642.884.3
Completeness [%]99.910099.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP82910.2 M ammonium phosphate, pH 8.1, 30% w/v PEG300, 0.1 M Tris, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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