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3MWO

Human carbonic anhydrase II in a doubled monoclinic cell: a re-determination

Replaces:  3KS1
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE A1
Synchrotron siteCHESS
BeamlineA1
Temperature [K]100
Detector technologyCCD
Collection date2009-04-22
DetectorADSC QUANTUM 210
Wavelength(s)0.9782
Spacegroup nameP 1 21 1
Unit cell lengths83.981, 41.057, 73.586
Unit cell angles90.00, 109.33, 90.00
Refinement procedure
Resolution18.279 - 1.400
R-factor0.167
Rwork0.166
R-free0.18400
Starting model (for MR)3KS1
RMSD bond length0.009
RMSD bond angle1.257
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwarePHENIX (1.6.1_348)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.450
High resolution limit [Å]1.4001.400
Rmerge0.0640.194
Number of reflections90618
<I/σ(I)>15.16.2
Completeness [%]96.895.5
Redundancy3.13
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.829350 mM Tris, 1.2 M sodium citrate, 5 ul + 5 ul droplet, pH 7.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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