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3MYO

Crystal structure of tagatose-1,6-bisphosphate aldolase from Streptococcus pyogenes

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPAL/PLS BEAMLINE 6C1
Synchrotron sitePAL/PLS
Beamline6C1
Temperature [K]100
Detector technologyCCD
Collection date2009-11-20
DetectorADSC QUANTUM 210
Wavelength(s)1.2399
Spacegroup nameP 43 21 2
Unit cell lengths126.149, 126.149, 148.701
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.980 - 2.500
R-factor0.20136
Rwork0.200
R-free0.22570
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3myp
RMSD bond length0.009
RMSD bond angle1.152
Data reduction softwareDENZO
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5.0102)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.590
High resolution limit [Å]2.5002.500
Rmerge0.0960.336
Number of reflections42128
<I/σ(I)>23.76.1
Completeness [%]100
Redundancy8.18.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP62870.1M sodium citrate, 0.1M MES, pH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 287K

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