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4Q8V

tRNA-Guanine Transglycosylase (TGT) in Complex with 4-[2-({6-Amino-8-oxo-1H,7H,8H-imidazo[4,5-g]quinazolin-2-yl}amino)ethyl]benzonitrile

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.2
Synchrotron siteBESSY
Beamline14.2
Temperature [K]100
Detector technologyCCD
Collection date2013-12-13
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)0.91841
Spacegroup nameC 1 2 1
Unit cell lengths91.164, 65.098, 70.760
Unit cell angles90.00, 96.31, 90.00
Refinement procedure
Resolution21.823 - 1.396
R-factor0.1329
Rwork0.131
R-free0.16270
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1pud
RMSD bond length0.006
RMSD bond angle1.063
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.8.4_1496))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.480
High resolution limit [Å]1.4001.400
Number of reflections79794
<I/σ(I)>112
Completeness [%]97.895.8
Redundancy2.92.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP5.5291.15100 mM MES, 10% DMSO, 13% PEG 8000, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 291.15K

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