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2NXR

Structural effects of hydrophobic mutations on the active site of human carbonic anhydrase II

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU300
Temperature [K]293
Detector technologyIMAGE PLATE
Collection date2006-01-05
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths42.815, 41.652, 72.933
Unit cell angles90.00, 104.67, 90.00
Refinement procedure
Resolution20.000 - 1.700
Rwork0.181
R-free0.19910
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1tbt
RMSD bond length0.004
RMSD bond angle1.350
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.760
High resolution limit [Å]1.7001.700
Number of reflections25613
Completeness [%]92.789.9
Redundancy3.93.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.229350 mM Tris-Cl pH 8.2, 2.6 M ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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