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9H8U

FAD-dependent oxidase sorD with sorbicillin bound

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE MASSIF-1
Synchrotron siteESRF
BeamlineMASSIF-1
Temperature [K]100
Detector technologyPIXEL
Collection date2024-03-03
DetectorDECTRIS PILATUS3 6M
Wavelength(s)0.965459
Spacegroup nameP 43 21 2
Unit cell lengths90.565, 90.565, 290.432
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution76.850 - 3.000
R-factor0.2101
Rwork0.206
R-free0.28590
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.012
RMSD bond angle1.329
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX (1.20_4459)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]290.4303.180
High resolution limit [Å]3.0003.000
Rmerge0.1671.300
Rmeas0.1761.451
Rpim0.0540.631
Total number of observations24778615607
Number of reflections244253287
<I/σ(I)>101.2
Completeness [%]96.8
Redundancy10.14.7
CC(1/2)0.9950.467
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.62930.1 M NaAcetate pH 4.6, 20% w/v PEG1000

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