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8QW3

Human NDPK-C in complex with ADP

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID23-1
Synchrotron siteESRF
BeamlineID23-1
Temperature [K]100
Detector technologyPIXEL
Collection date2020-12-11
DetectorDECTRIS PILATUS 6M-F
Wavelength(s)1.0052
Spacegroup nameP 1
Unit cell lengths52.315, 67.865, 68.423
Unit cell angles108.49, 112.34, 101.11
Refinement procedure
Resolution60.119 - 1.255
Rwork0.147
R-free0.17550
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.012
RMSD bond angle1.671
Data reduction softwareMOSFLM
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0419)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]60.1201.280
High resolution limit [Å]1.2501.250
Rmerge0.0490.947
Rmeas0.0601.339
Rpim0.0330.947
Number of reflections1986029337
<I/σ(I)>8.60.7
Completeness [%]94.289
Redundancy2.81.8
CC(1/2)0.9700.401
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION5.42916% PEG 3350, 150 mM Li2SO4, 100 mM Tri-sodium citrate pH 5.4

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