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4LBU

tRNA guanine transglycosylase (TGT) in complex with Furanoside-Based lin-Benzoguanine 2

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.2
Synchrotron siteBESSY
Beamline14.2
Temperature [K]100
Detector technologyCCD
Collection date2012-11-17
DetectorRAYONIX MX-225
Wavelength(s)0.85507
Spacegroup nameC 1 2 1
Unit cell lengths90.341, 65.197, 70.588
Unit cell angles90.00, 96.32, 90.00
Refinement procedure
Resolution14.910 - 1.170
R-factor0.1364
Rwork0.136
R-free0.15170
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1pud
RMSD bond length0.006
RMSD bond angle1.119
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.8.1_1168))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.190
High resolution limit [Å]1.1701.170
Number of reflections136269
<I/σ(I)>23.52.1
Completeness [%]99.497.6
Redundancy3.12.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.528813% PEG 8000, 100mM MES, 1mM DTT, 10% DMSO, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 288K

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