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4LJO

Structure of an active ligase (HOIP)/ubiquitin transfer complex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I02
Synchrotron siteDiamond
BeamlineI02
Temperature [K]100
Detector technologyPIXEL
Collection date2012-01-01
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.920
Spacegroup nameP 31
Unit cell lengths45.950, 45.950, 133.010
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution44.337 - 1.564
R-factor0.1828
Rwork0.181
R-free0.21240
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4ljq
RMSD bond length0.006
RMSD bond angle1.032
Data reduction softwareCCP4
Data scaling softwareXSCALE
Phasing softwarePHASER (2.3.0)
Refinement softwarePHENIX
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]44.3401.600
High resolution limit [Å]1.5606.9801.560
Rmerge0.0390.0400.593
Number of reflections44055
<I/σ(I)>12.216.711.52
Completeness [%]99.288.594
Redundancy3.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION6.52930.1 M carboxylic acids, 0.1 M imidazole, MES, 30 % P550 MME_P20K, pH 6.5, vapour diffusion, temperature 293K, VAPOR DIFFUSION

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