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1R0C

Products in the T State of Aspartate Transcarbamylase: Crystal Structure of the Phosphate and N-carbamyl-L-aspartate Ligated Enzyme

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE F1
Synchrotron siteCHESS
BeamlineF1
Temperature [K]100
Detector technologyCCD
Collection date2002-05-12
DetectorADSC QUANTUM 4
Wavelength(s)0.928
Spacegroup nameH 3
Unit cell lengths128.776, 128.776, 198.017
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution50.000 - 2.370
R-factor0.228
Rwork0.226
R-free0.27400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1d09
RMSD bond length0.007
RMSD bond angle1.424
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS (1.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.450
High resolution limit [Å]2.3702.370
Number of reflections46167
<I/σ(I)>122.1
Completeness [%]92.875.5
Redundancy21.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5294PEG 4000, Hepes-Na, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 294K

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