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3UCN

Coccomyxa beta-carbonic anhydrase in complex with azide

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsENRAF-NONIUS FR591
Temperature [K]293
Detector technologyIMAGE PLATE
Collection date2000-11-20
DetectorMAC Science DIP-2030
Wavelength(s)1.5418
Spacegroup nameP 43 21 2
Unit cell lengths75.651, 75.651, 222.221
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution24.317 - 2.250
R-factor0.16075
Rwork0.159
R-free0.19982
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3ucj
RMSD bond length0.023
RMSD bond angle1.909
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareREFMAC (5.5.0110)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]24.3172.370
High resolution limit [Å]2.2502.250
Number of reflections29541
Completeness [%]99.197.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.22911.6-2.3 M sodium/potassium phosphate, 2.5 mM azide, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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