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5ZO6

Crystal structure of C166, a backbone circularized G-CSF

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron sitePhoton Factory
BeamlineAR-NW12A
Temperature [K]100
Detector technologyCCD
Collection date2016-03-11
DetectorADSC QUANTUM 270
Wavelength(s)1.0000
Spacegroup nameP 21 21 21
Unit cell lengths47.180, 48.050, 54.960
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution36.170 - 1.700
R-factor0.16972
Rwork0.167
R-free0.21672
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1bgc
RMSD bond length0.019
RMSD bond angle1.884
Data reduction softwareiMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0103)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.1501.730
High resolution limit [Å]1.7001.700
Rmerge0.0600.271
Number of reflections14235747
<I/σ(I)>21.87.3
Completeness [%]99.799.5
Redundancy6.97.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.2298sodium acetate trihydrate, sodium chloride dehydrate, PEG 1500, MPD

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