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5FIG

APO-CSP3 (COPPER STORAGE PROTEIN 3) FROM BACILLUS SUBTILIS

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND
Synchrotron siteDiamond
BeamlineI02
Temperature [K]100
Detector technologyPIXEL
Collection date2014-01-26
DetectorDECTRIS PILATUS 6M
Spacegroup nameC 2 2 21
Unit cell lengths107.087, 126.510, 85.736
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution81.740 - 1.700
R-factor0.22085
Rwork0.220
R-free0.24262
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5arm
RMSD bond length0.016
RMSD bond angle1.847
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0124)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]45.4101.730
High resolution limit [Å]1.7001.700
Rmerge0.0900.710
Number of reflections64008
<I/σ(I)>81.5
Completeness [%]98.798
Redundancy5.65.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1200 MM NACL, 100 MM CITRATE PH 4, 800 MM AMMONIUM SULFATE

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