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3S0E

Apis mellifera OBP14 in complex with the odorant eugenol (2-methoxy-4(2-propenyl)-phenol)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSOLEIL BEAMLINE PROXIMA 1
Synchrotron siteSOLEIL
BeamlinePROXIMA 1
Temperature [K]100
Detector technologyCCD
Collection date2011-02-24
DetectorADSC QUANTUM 315r
Spacegroup nameP 21 21 21
Unit cell lengths34.610, 40.260, 91.990
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution32.390 - 1.600
R-factor0.1904
Rwork0.190
R-free0.20050
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3s0a
RMSD bond length0.008
RMSD bond angle1.070
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareBUSTER (2.9.2)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]45.0001.640
High resolution limit [Å]1.6001.600
Rmerge0.0100.360
Number of reflections17204
<I/σ(I)>154.4
Completeness [%]98.492.2
Redundancy9.65.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP9.82931.8-1.9 M tri-sodium citrate, 25 mM CHES, pH 9.8, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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