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3ZUY

Crystal structure of a bacterial homologue of the bile acid sodium symporter ASBT.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I02
Synchrotron siteDiamond
BeamlineI02
Temperature [K]100
Detector technologyCCD
Collection date2011-01-28
DetectorADSC CCD
Spacegroup nameP 41 2 2
Unit cell lengths73.350, 73.350, 162.450
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution24.420 - 2.200
R-factor0.2132
Rwork0.212
R-free0.24470
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3zux
RMSD bond length0.010
RMSD bond angle1.040
Data reduction softwareXDS
Data scaling softwareSCALEPACK
Phasing softwareBUSTER
Refinement softwareBUSTER (2.8.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]24.4002.260
High resolution limit [Å]2.2002.200
Rmerge0.0800.900
Number of reflections22917
<I/σ(I)>9.42
Completeness [%]98.999.5
Redundancy6.86
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
14.550 MM SODIUM CITRATE PH 4.5, 70 MM NACL, AND 22-24% PEG400.

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