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2WW3

Structure of the Family GH92 Inverting Mannosidase BT3990 from Bacteroides thetaiotaomicron VPI-5482 in complex with thiomannobioside

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-1
Synchrotron siteESRF
BeamlineID14-1
Temperature [K]100
Detector technologyCCD
Collection date2009-07-04
DetectorADSC CCD
Spacegroup nameP 1 21 1
Unit cell lengths161.260, 68.590, 204.009
Unit cell angles90.00, 94.66, 90.00
Refinement procedure
Resolution203.330 - 2.100
R-factor0.1925
Rwork0.190
R-free0.24366
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2wvx
RMSD bond length0.010
RMSD bond angle1.231
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareREFMAC (5.4.0077)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.180
High resolution limit [Å]2.1002.100
Rmerge0.0500.360
Number of reflections239524
<I/σ(I)>15.42
Completeness [%]97.795.4
Redundancy3.22.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1

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