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6BLM

Crystal Structure of Native Fused 4-OT

Replaces:  5UN4
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.1
Synchrotron siteALS
Beamline5.0.1
Temperature [K]100
Detector technologyCCD
Collection date2016-07-03
DetectorADSC QUANTUM 315r
Wavelength(s)0.977408
Spacegroup nameP 21 21 21
Unit cell lengths47.814, 67.229, 94.840
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution42.695 - 1.488
R-factor0.1912
Rwork0.190
R-free0.21110
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5unq
RMSD bond length0.007
RMSD bond angle1.104
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX (1.9_1692)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.6951.540
High resolution limit [Å]1.4881.490
Number of reflections50550
<I/σ(I)>25.49
Completeness [%]99.7
Redundancy7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.529833% PEG 8000 0.1 M HEPES pH 7.5

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