7K3Z
P. falciparum Cpn60 D474A mutant bound to ATP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-02-25 |
Detector | RIGAKU HyPix-6000HE |
Wavelength(s) | 1.0 |
Spacegroup name | P 63 2 2 |
Unit cell lengths | 281.498, 281.498, 298.827 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 51.990 - 3.690 |
R-factor | 0.2279 |
Rwork | 0.227 |
R-free | 0.27650 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4v4o |
RMSD bond length | 0.003 |
RMSD bond angle | 0.803 |
Data reduction software | XDS (Version Jan. 31, 2020) |
Data scaling software | XDS (Version Jan. 31, 2020) |
Phasing software | PHENIX (1.14_3260) |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 63.000 | 3.790 |
High resolution limit [Å] | 3.690 | 3.690 |
Rmeas | 0.133 | 1.500 |
Number of reflections | 75184 | 5368 |
<I/σ(I)> | 12.93 | 1.7 |
Completeness [%] | 98.8 | 98.3 |
Redundancy | 9.1 | |
CC(1/2) | 0.999 | 0.607 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.4 | 291 | 100 mM phosphate citrate buffer pH 4.4, 13% Isopropanol, and 0.21 mM of Lithium Sulfate |