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4F1W

Crystal structure of 5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase from Salmonella enterica with Adenine

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X29A
Synchrotron siteNSLS
BeamlineX29A
Temperature [K]100
Detector technologyCCD
Collection date2011-08-25
DetectorADSC QUANTUM 315r
Wavelength(s)1.075
Spacegroup nameP 21 21 21
Unit cell lengths66.050, 68.120, 89.660
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution41.950 - 1.360
R-factor0.11455
Rwork0.113
R-free0.14597
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3o4v
RMSD bond length0.010
RMSD bond angle1.435
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.7.0025)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]54.2401.430
High resolution limit [Å]1.3601.360
Rmerge0.112
Number of reflections87459
<I/σ(I)>12.92.6
Completeness [%]100.099.9
Redundancy11.511.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP82931.0M (NH4)2HPO4, 0.1M Imidazole, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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