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4FCZ

Crystal Structure of Toluene-tolerance protein from Pseudomonas putida (strain KT2440), Northeast Structural Genomics Consortium (NESG) Target PpR99

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X4C
Synchrotron siteNSLS
BeamlineX4C
Temperature [K]100
Detector technologyCCD
Collection date2011-04-14
DetectorMAR CCD 165 mm
Wavelength(s)0.979
Spacegroup nameP 1 21 1
Unit cell lengths79.868, 40.883, 82.399
Unit cell angles90.00, 106.49, 90.00
Refinement procedure
Resolution39.086 - 2.604
R-factor0.2367
Rwork0.233
R-free0.29760
Structure solution methodSAD
RMSD bond length0.009
RMSD bond angle1.189
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwarePHENIX ((AutoSolve))
Refinement softwarePHENIX (dev_1269)
Data quality characteristics
 Overall
Low resolution limit [Å]39.086
High resolution limit [Å]2.600
Rmerge0.112
Number of reflections28693
<I/σ(I)>10
Completeness [%]94.7
Redundancy5.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5Protein solution: 100mM NaCl, 5mM DTT, 0.02% NaN3, 10mM Tris-HCl, pH 7.5, VAPOR DIFFUSION, HANGING DROP

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