6ZHI
Structure of the Plasmodium falciparum Hsp70-x substrate binding domain in complex with hydrophobic peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-06-26 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9793 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 71.069, 93.853, 85.296 |
Unit cell angles | 90.00, 99.47, 90.00 |
Refinement procedure
Resolution | 84.130 - 3.250 |
R-factor | 0.298 |
Rwork | 0.297 |
R-free | 0.32100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4po2 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.120 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 93.890 | 3.310 |
High resolution limit [Å] | 3.250 | 3.250 |
Rmerge | 0.116 | 1.857 |
Rmeas | 0.125 | 2.016 |
Rpim | 0.048 | 0.777 |
Number of reflections | 17457 | 796 |
<I/σ(I)> | 8.7 | 1.5 |
Completeness [%] | 99.8 | 94.09 |
Redundancy | 6.9 | 1.5 |
CC(1/2) | 1.000 | 0.568 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 0.1 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 |