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1ZRS

wild-type LD-carboxypeptidase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsMPG/DESY, HAMBURG BEAMLINE BW6
Synchrotron siteMPG/DESY, HAMBURG
BeamlineBW6
Temperature [K]100
Detector technologyCCD
Collection date2004-11-21
DetectorMARRESEARCH
Wavelength(s)1.05
Spacegroup nameP 1 21 1
Unit cell lengths52.185, 78.271, 71.258
Unit cell angles90.00, 104.33, 90.00
Refinement procedure
Resolution20.000 - 1.500
R-factor0.16442
Rwork0.164
R-free0.17730
Structure solution methodMIRAS
RMSD bond length0.013
RMSD bond angle1.460
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMLPHARE
Refinement softwareREFMAC (5.1.24)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.520
High resolution limit [Å]1.5001.500
Rmerge0.0370.252
Number of reflections86224
<I/σ(I)>20.94
Completeness [%]97.195.1
Redundancy2.22
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.5294citric acid, pH 4.5, VAPOR DIFFUSION, SITTING DROP, temperature 294K

220113

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