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5U09

High-resolution crystal structure of the human CB1 cannabinoid receptor

Replaces:  5TJV
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 23-ID-D
Synchrotron siteAPS
Beamline23-ID-D
Temperature [K]100
Detector technologyPIXEL
Collection date2016-07-31
DetectorDECTRIS PILATUS 6M
Wavelength(s)1.033
Spacegroup nameP 1 21 1
Unit cell lengths50.652, 80.381, 81.178
Unit cell angles90.00, 91.72, 90.00
Refinement procedure
Resolution50.010 - 2.600
R-factor0.1832
Rwork0.180
R-free0.23820
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3v2y
RMSD bond length0.009
RMSD bond angle1.200
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0155)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.01050.0002.690
High resolution limit [Å]2.6005.6002.600
Rmerge0.1940.0701.411
Number of reflections19781
<I/σ(I)>5.6
Completeness [%]96.994.296.8
Redundancy5.45.35.1
CC(1/2)0.9950.690
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1LIPIDIC CUBIC PHASE5.529331% PEG400, 100mM Sodium Citrate pH5.5, 100mM magnesium sulfate

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