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8TYF

Plasmodium vivax PMV-WM06 inhibitor complex

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron siteAustralian Synchrotron
BeamlineMX2
Temperature [K]100
Detector technologyCCD
Collection date2016-04-26
DetectorADSC QUANTUM 315
Wavelength(s)0.95370
Spacegroup nameI 2 2 2
Unit cell lengths60.720, 81.850, 192.876
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution48.770 - 2.590
R-factor0.1869
Rwork0.184
R-free0.24090
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.002
RMSD bond angle0.548
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX (1.20.1_4487)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]48.7702.687
High resolution limit [Å]2.5902.590
Rmeas0.139
Rpim0.422
Number of reflections152651462
<I/σ(I)>12.171.54
Completeness [%]99.697.99
Redundancy8
CC(1/2)0.707
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.8829320% PEG 3350 0.2M Na2HPO4/KH2PO4

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