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2NSX

Structure of acid-beta-glucosidase with pharmacological chaperone provides insight into Gaucher disease

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 23-ID-B
Synchrotron siteAPS
Beamline23-ID-B
Temperature [K]100
Detector technologyCCD
Collection date2005-09-30
DetectorMARRESEARCH
Wavelength(s)1
Spacegroup nameP 1 21 1
Unit cell lengths108.967, 92.216, 152.670
Unit cell angles90.00, 110.94, 90.00
Refinement procedure
Resolution50.000 - 2.110
R-factor0.19319
Rwork0.191
R-free0.23492
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ogs
RMSD bond length0.014
RMSD bond angle1.527
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.160
High resolution limit [Å]2.1002.100
Number of reflections149310
<I/σ(I)>13.13
Completeness [%]91.570.4
Redundancy3.83.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.52981 M Ammonium Sulfate 0.17 M Guanidinium HCl 0.02 M KCl 0.1 M Acetate buffer pH 4.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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