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5I3D

Sulfolobus solfataricus beta-glycosidase - E387Y mutant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSRS BEAMLINE PX9.6
Synchrotron siteSRS
BeamlinePX9.6
Temperature [K]100
Detector technologyCCD
Collection date2004-09-19
DetectorADSC QUANTUM 4r
Wavelength(s)0.87
Spacegroup nameP 21 21 21
Unit cell lengths92.680, 129.060, 191.760
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution42.528 - 2.160
R-factor0.1719
Rwork0.170
R-free0.20300
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1gow
RMSD bond length0.003
RMSD bond angle0.633
Data reduction softwarexia2 (0.4)
Data scaling softwareAimless
Phasing softwarePHENIX (1.10.1_2155)
Refinement softwarePHENIX (1.10.1_2155)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.5282.220
High resolution limit [Å]2.1602.160
Rmerge0.1900.400
Number of reflections119882
<I/σ(I)>11.22.3
Completeness [%]97.061
Redundancy10.82.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP3.25291PEG 4000, sodium acetate, ammonium acetate

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