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1YPV

Structure of human thymidylate synthase at low salt conditions

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]100
Detector technologyCCD
Collection date2003-06-03
DetectorSBC-1
Wavelength(s)0.9793
Spacegroup nameP 31 2 1
Unit cell lengths95.772, 95.772, 81.851
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution41.330 - 1.800
R-factor0.2265
Rwork0.227
R-free0.24350
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.006
RMSD bond angle1.400
Data reduction softwareHKL-2000
Data scaling softwared*TREK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.860
High resolution limit [Å]1.8001.800
Rmerge0.0600.563
Number of reflections40526
<I/σ(I)>14.5
Completeness [%]93.691.2
Redundancy4.82.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.5298PEG 4000, TRIS BUFFER, AMMONIUM SULFATE, 2-MERCAPTOETHANOL, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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