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4N1N

Structure of Cyclophilin A in complex with Benzamide.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]100
Detector technologyPIXEL
Collection date2009-09-14
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.97630
Spacegroup nameP 21 21 21
Unit cell lengths42.910, 53.610, 87.620
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution22.860 - 1.500
R-factor0.16866
Rwork0.166
R-free0.21283
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.026
RMSD bond angle2.024
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.9101.580
High resolution limit [Å]1.5001.500
Number of reflections32933
Completeness [%]99.499.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8277Tris, PEG8000, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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