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2Z8J

Crystal Structure of Escherichia coli gamma-Glutamyltranspeptidase in Complex with Azaserine prepared in the dark

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL41XU
Synchrotron siteSPring-8
BeamlineBL41XU
Temperature [K]100
Detector technologyCCD
Collection date2006-04-16
DetectorADSC QUANTUM 315
Wavelength(s)1.0000
Spacegroup nameP 21 21 21
Unit cell lengths76.260, 126.800, 128.100
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution40.140 - 2.050
R-factor0.227
Rwork0.227
R-free0.26700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2dbu
RMSD bond length0.008
RMSD bond angle1.400
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.120
High resolution limit [Å]2.0502.050
Rmerge0.0710.331
Number of reflections78471
<I/σ(I)>15.1
Completeness [%]99.8100
Redundancy1212.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.427712.5-17.5% PEG 4000, 0.2M CaCl2, 0.1M Tris-HCl, pH 8.4, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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