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1ME6

CRYSTAL STRUCTURE OF PLASMEPSIN II, AN ASPARTYL PROTEASE FROM PLASMODIUM FALCIPARUM, IN COMPLEX WITH A STATINE-BASED INHIBITOR

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2001-07-18
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 31 2 1
Unit cell lengths141.930, 141.930, 97.820
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution50.000 - 2.700
Rwork0.214
R-free0.27110
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1sme
RMSD bond length0.008
RMSD bond angle1.576
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 Overall
Low resolution limit [Å]50.000
High resolution limit [Å]2.700
Number of reflections28346
Completeness [%]89.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.5291ammonium sulfate, sodium phosphate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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