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3NBM

The lactose-specific IIB component domain structure of the phosphoenolpyruvate:carbohydrate phosphotransferase system (PTS) from Streptococcus pneumoniae.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-BM
Synchrotron siteAPS
Beamline19-BM
Temperature [K]100
Detector technologyCCD
Collection date2009-12-20
DetectorADSC QUANTUM 210r
Wavelength(s)0.97934
Spacegroup nameP 43 21 2
Unit cell lengths41.372, 41.372, 98.527
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution25.150 - 1.300
R-factor0.134
Rwork0.132
R-free0.16700
Structure solution methodSAD
RMSD bond length0.015
RMSD bond angle1.443
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMLPHARE
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.320
High resolution limit [Å]1.3001.300
Rmerge0.0720.370
Number of reflections21377
<I/σ(I)>11.4
Completeness [%]97.381.3
Redundancy13.36.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.52770.2M Ammonium Acetate, 0.1M HEPES pH 7.5, 25% PEG 3350, VAPOR DIFFUSION, SITTING DROP, temperature 277K

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