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5JXQ

TRNA-GUANINE TRANSGLYCOSYLASE (TGT) IN COMPLEX WITH 6-AMINO-2-{[4-(2-HYDROXYETHYL)PHENETHYL]AMINO}-1,7-DIHYDRO-8H-IMIDAZO[4,5-g]QUINAZOLIN-8-ONE

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron sitePETRA III, EMBL c/o DESY
BeamlineP14 (MX2)
Temperature [K]100
Detector technologyPIXEL
Collection date2013-11-14
DetectorDECTRIS PILATUS 6M-F
Wavelength(s)0.97627
Spacegroup nameC 1 2 1
Unit cell lengths90.220, 64.760, 70.340
Unit cell angles90.00, 96.16, 90.00
Refinement procedure
Resolution69.934 - 1.200
R-factor0.1379
Rwork0.137
R-free0.15700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1pud
RMSD bond length0.005
RMSD bond angle1.134
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwarePHENIX (1.8.4_1496)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]80.0001.240
High resolution limit [Å]1.2001.200
Number of reflections123477
<I/σ(I)>19.8
Completeness [%]98.3
Redundancy3.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP291100 MM MES, 10% DMSO, 13% PEG 8000, PH 5.5

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