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1SK8

Crystallographic snapshots of Aspergillus fumigatus phytase revealing its enzymatic dynamics

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE A1
Synchrotron siteCHESS
BeamlineA1
Temperature [K]100
Detector technologyCCD
Collection date2003-10-21
DetectorADSC QUANTUM 210
Spacegroup nameP 21 21 21
Unit cell lengths39.714, 99.484, 100.751
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.000 - 1.650
R-factor0.17765
Rwork0.175
R-free0.23061
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.015
RMSD bond angle1.571
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.1.24)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.680
High resolution limit [Å]1.6501.650
Number of reflections45787
Completeness [%]93.580.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP5.5300PEG 4000, magnesium chloride hexahydrate, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 300K

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