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1OFR

CRYSTAL STRUCTURE OF THE TYROSINE-REGULATED 3-DEOXY-D-ARABINO-HEPTULOSONATE-7-PHOSPHATE SYNTHASE FROM SACCHAROMYCES CEREVISIAE COMPLEXED WITH PHENYLALANINE AND MANGANESE

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsEMBL/DESY, HAMBURG BEAMLINE BW7B
Synchrotron siteEMBL/DESY, HAMBURG
BeamlineBW7B
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2002-04-15
DetectorMARRESEARCH
Spacegroup nameP 1
Unit cell lengths82.287, 94.034, 105.121
Unit cell angles65.14, 85.68, 75.73
Refinement procedure
Resolution37.200 - 2.700
R-factor0.232
Rwork0.232
R-free0.27400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)MOLECULE A OF PDB-CODE 1HFB
RMSD bond length0.008
RMSD bond angle1.300
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareEPMR
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]37.0002.800
High resolution limit [Å]2.7002.690
Rmerge0.0670.330
Number of reflections155910
<I/σ(I)>11.83.5
Completeness [%]91.278.1
Redundancy2.11.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
18pH 8.00

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