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6ZHI

Structure of the Plasmodium falciparum Hsp70-x substrate binding domain in complex with hydrophobic peptide

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]100
Detector technologyPIXEL
Collection date2019-06-26
DetectorDECTRIS PILATUS3 6M
Wavelength(s)0.9793
Spacegroup nameP 1 21 1
Unit cell lengths71.069, 93.853, 85.296
Unit cell angles90.00, 99.47, 90.00
Refinement procedure
Resolution84.130 - 3.250
R-factor0.298
Rwork0.297
R-free0.32100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4po2
RMSD bond length0.009
RMSD bond angle1.120
Data reduction softwarexia2
Data scaling softwarexia2
Phasing softwarePHASER
Refinement softwareBUSTER (2.10.3)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]93.8903.310
High resolution limit [Å]3.2503.250
Rmerge0.1161.857
Rmeas0.1252.016
Rpim0.0480.777
Number of reflections17457796
<I/σ(I)>8.71.5
Completeness [%]99.894.09
Redundancy6.91.5
CC(1/2)1.0000.568
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8.52930.1 M bicine/2-Amino-2-(hydroxymethyl)propane-1,3-diol base 10% w/v PEG 20,000 20% w/v PEG MME 550 0.03 M of each of di- to penta-ethyleneglycol

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