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4OI6

Crystal structure analysis of nickel-bound form SCO4226 from Streptomyces coelicolor A3(2)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2008-11-13
DetectorMAR scanner 345 mm plate
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths28.330, 67.140, 35.090
Unit cell angles90.00, 94.98, 90.00
Refinement procedure
Resolution17.536 - 2.040
R-factor0.1729
Rwork0.171
R-free0.21650
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.067
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwarePHENIX ((phenix.refine: 1.8.2_1309))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]17.5362.140
High resolution limit [Å]2.0402.040
Number of reflections8364
Completeness [%]98.388.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.52890.8 M sodium citrate dihydrate, pH 6.5 and 0.8 M NiSO4, VAPOR DIFFUSION, HANGING DROP, temperature 289K

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