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5A3A

Crystal structure of the ADP-ribosylating sirtuin (SirTM) from Streptococcus pyogenes (Apo form)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I04-1
Synchrotron siteDiamond
BeamlineI04-1
Temperature [K]100
Detector technologyPIXEL
Collection date2014-08-07
DetectorDECTRIS PILATUS 2M
Spacegroup nameP 1
Unit cell lengths34.160, 41.510, 51.230
Unit cell angles99.87, 94.63, 90.77
Refinement procedure
Resolution34.810 - 1.540
R-factor0.15205
Rwork0.150
R-free0.19998
Structure solution methodSAD
Starting model (for MR)NONE
RMSD bond length0.016
RMSD bond angle1.421
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwareautoSHARP
Refinement softwareREFMAC (5.8.0071)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]34.8101.580
High resolution limit [Å]1.5401.540
Rmerge0.0600.550
Number of reflections36095
<I/σ(I)>10.62
Completeness [%]88.382.8
Redundancy3.83.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
180.1 M AMINO ACIDS, 0.1 M BUFFER SYSTEM 1 (PH 6.5), 30.00% (V/V) EDO_P8K (THESE ARE COMPONENTS OF THE MORPHEUS SCREEN FROM MOLECULAR DIMENSIONS)

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