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3RHS

Phosphopantetheine adenylyltransferase from Mycobacterium tuberculosis complexed with CoA

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL41XU
Synchrotron siteSPring-8
BeamlineBL41XU
Temperature [K]100
Detector technologyCCD
Collection date2009-01-01
DetectorADSC QUANTUM 315r
Spacegroup nameH 3 2
Unit cell lengths98.886, 98.886, 114.869
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution9.700 - 1.590
R-factor0.212
Rwork0.210
R-free0.25610
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.004
RMSD bond angle0.924
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine))
Data quality characteristics
 Overall
Low resolution limit [Å]40.000
High resolution limit [Å]1.500
Rmerge0.048
Number of reflections34704
Completeness [%]98.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1

226707

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