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7SVM

DPP8 IN COMPLEX WITH LIGAND ICeD-2

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X10SA
Synchrotron siteSLS
BeamlineX10SA
Temperature [K]100
Detector technologyPIXEL
Collection date2019-02-03
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.9998
Spacegroup nameC 2 2 21
Unit cell lengths162.288, 244.937, 261.487
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution135.290 - 2.690
R-factor0.1768
Rwork0.176
R-free0.21640
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6eoo
RMSD bond length0.012
RMSD bond angle1.689
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0155)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]135.2902.940
High resolution limit [Å]2.6902.690
Rmerge0.0640.580
Number of reflections13823532528
<I/σ(I)>1.97
Completeness [%]96.197.3
Redundancy32.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION2770.46 M NaCitrate pH 6.75

219869

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