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4CCE

STRUCTURE OF MOUSE GALACTOCEREBROSIDASE WITH GALACTOSE: ENZYME- PRODUCT COMPLEX

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I04-1
Synchrotron siteDiamond
BeamlineI04-1
Temperature [K]100
Detector technologyPIXEL
Collection date2012-08-03
DetectorDECTRIS PILATUS 2M
Spacegroup nameH 3 2
Unit cell lengths248.754, 248.754, 77.632
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution44.251 - 2.060
R-factor0.1732
Rwork0.172
R-free0.20600
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3ZR5 (WITH SOLVENT REMOVED)
RMSD bond length0.007
RMSD bond angle1.066
Data reduction softwareiMOSFLM
Data scaling softwareAimless
Phasing softwarePHENIX
Refinement softwarePHENIX ((PHENIX.REFINE))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.0102.120
High resolution limit [Å]2.0602.060
Rmerge0.1401.400
Number of reflections56396
<I/σ(I)>13.92.4
Completeness [%]99.9100
Redundancy13.513.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.834% PEG 8000, 200 MM SODIUM ACETATE, 100 MM SODIUM CACODYLATE PH 6.8

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