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4HEI

2A X-RAY STRUCTURE OF HPF from VIBRIO CHOLERAE

Replaces:  4FYL
Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE F2
Synchrotron siteCHESS
BeamlineF2
Temperature [K]100
Detector technologyCCD
Collection date2008-11-23
DetectorADSC QUANTUM 210
Wavelength(s)0.9790, 1.604
Spacegroup nameP 41 21 2
Unit cell lengths46.354, 46.354, 174.492
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution43.620 - 1.600
R-factor0.262
Rwork0.262
R-free0.28100
Structure solution methodMAD
RMSD bond length0.005
RMSD bond angle1.100
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHENIX (AUTOSOL)
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]43.6201.630
High resolution limit [Å]1.6001.600
Number of reflections21120
<I/σ(I)>15.41.26
Completeness [%]80.018.5
Redundancy4.11.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.52941.2M AMMONIUM SULFATE, 0.01 M CO(II) CL2, 0.1M MES 6.5 ADDITIVE 2M SODIUM THIOCYANATE MIXED ABOVE COMPONENTS WITH EQUAL VOLUME OF PROTEIN, PH 7.5, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 294K

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