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8WDW

Crystal structure of a novel PU plastic degradation urethanase UMG-SP2 from uncultured bacterium

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL19U1
Synchrotron siteSSRF
BeamlineBL19U1
Temperature [K]100
Detector technologyPIXEL
Collection date2023-09-07
DetectorDECTRIS PILATUS3 6M
Wavelength(s)0.987
Spacegroup nameP 43 21 2
Unit cell lengths88.430, 88.430, 277.780
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.220 - 2.160
R-factor0.1664
Rwork0.164
R-free0.20660
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.003
RMSD bond angle0.604
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX ((1.21_5207: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.220
High resolution limit [Å]2.1602.160
Number of reflections599404311
<I/σ(I)>12.981.88
Completeness [%]99.7
Redundancy13.611.4
CC(1/2)0.9980.831
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8.5298MgCl2, Tris, PEG4000

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