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4UAN

Structure of the Ssl1 laccase mutant H99Q with depleted type-2 copper ion

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-4
Synchrotron siteESRF
BeamlineID14-4
Temperature [K]100
Detector technologyCCD
Collection date2013-07-22
DetectorADSC QUANTUM 315r
Wavelength(s)0.97858
Spacegroup nameP 21 21 21
Unit cell lengths51.522, 104.274, 163.086
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution52.140 - 1.800
R-factor0.15339
Rwork0.151
R-free0.19360
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4m3h
RMSD bond length0.023
RMSD bond angle2.166
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0071)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]54.3601.900
High resolution limit [Å]1.8001.800
Rmerge0.299
Number of reflections82406
<I/σ(I)>23.36.5
Completeness [%]100.0100
Redundancy7.37.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7293100 mM HEPES, pH 7.0, 1.0-1.3 M ammonium sulfate, 5-20 mM hexamminecobalt(III) chloride

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