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1Y79

Crystal Structure of the E.coli Dipeptidyl Carboxypeptidase Dcp in Complex with a Peptidic Inhibitor

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsMPG/DESY, HAMBURG BEAMLINE BW6
Synchrotron siteMPG/DESY, HAMBURG
BeamlineBW6
Temperature [K]100
Detector technologyCCD
Collection date2003-07-15
DetectorMARRESEARCH
Wavelength(s)1.050, 0.97880, 0.97910, 0.95000
Spacegroup nameP 21 21 21
Unit cell lengths63.408, 67.921, 153.591
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 2.000
R-factor0.2403
Rwork0.214
R-free0.27470
Structure solution methodMAD
RMSD bond length0.010
RMSD bond angle1.370
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.060
High resolution limit [Å]2.0002.000
Rmerge0.0800.341
Number of reflections45498
<I/σ(I)>12.6
Completeness [%]99.999.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP82940.2 M potassium nitrate, 18% (w/v) PEG 3350, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 294K

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