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3BOB

Carbonic anhydrase from marine diatom Thalassiosira weissflogii- cadmium bound domain 2

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X29A
Synchrotron siteNSLS
BeamlineX29A
Temperature [K]100
Detector technologyCCD
Collection date2006-11-13
DetectorADSC QUANTUM 315
Wavelength(s)1.08
Spacegroup nameP 21 21 2
Unit cell lengths64.283, 78.202, 37.054
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution24.830 - 1.450
R-factor0.167
Rwork0.167
R-free0.19400
Structure solution methodSAD
RMSD bond length0.008
RMSD bond angle1.600
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareSHELXS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.450
High resolution limit [Å]1.4001.400
Number of reflections35966
Completeness [%]95.492.5
Redundancy6.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.52980.1 M sodium citrate, 20% (w/v) PEG3350, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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