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7DNN

Crystal structure of the AgCarB2-C2 complex with homoorientin

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE AR-NE3A
Synchrotron sitePhoton Factory
BeamlineAR-NE3A
Temperature [K]95
Detector technologyPIXEL
Collection date2019-12-06
DetectorDECTRIS PILATUS 2M-F
Wavelength(s)1.0000
Spacegroup nameP 21 21 2
Unit cell lengths73.905, 102.511, 136.090
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution36.170 - 2.250
R-factor0.1989
Rwork0.196
R-free0.24710
Structure solution methodSAD
RMSD bond length0.008
RMSD bond angle0.935
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareCRANK2
Refinement softwarePHENIX (1.18_3845)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.9702.370
High resolution limit [Å]2.2502.250
Rmerge0.0540.852
Number of reflections9466813699
<I/σ(I)>17.49
Completeness [%]99.8
Redundancy4.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION29325%(w/v) PEG4000, 0.1 M MES pH 6.5, 0.2 M Potassium Iodide

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