6HRC
Outward-facing PglK with ATPgammaS bound
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 293 |
Detector technology | PIXEL |
Collection date | 2016-09-30 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 125.680, 145.980, 206.760 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.995 - 3.300 |
R-factor | 0.2349 |
Rwork | 0.232 |
R-free | 0.28380 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5c78 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 19.995 | 24.952 | 3.380 |
High resolution limit [Å] | 3.300 | 14.330 | 3.300 |
Rmerge | 0.032 | 1.977 | |
Rmeas | 0.181 | 0.033 | 2.057 |
Number of reflections | 52311 | 708 | 1110 |
<I/σ(I)> | 1.34 | 57.81 | 1.6 |
Completeness [%] | 90.8 | 87.3 | 24.7 |
Redundancy | 13.8 | 12.294 | 13.151 |
CC(1/2) | 0.999 | 0.459 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6 | 298 | Na3Citrate: NaCl:MgCl2:ATPgammaS:PEG400 |