6XPI
CutR flat hexamer, form 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-12-12 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.971700 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 135.360, 76.140, 67.810 |
Unit cell angles | 90.00, 119.72, 90.00 |
Refinement procedure
Resolution | 63.910 - 2.600 |
R-factor | 0.2049 |
Rwork | 0.201 |
R-free | 0.24170 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6xpk |
RMSD bond length | 0.008 |
RMSD bond angle | 1.060 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER (2.8.3) |
Refinement software | BUSTER (2.10.3 (20-MAY-2020)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 63.910 | 63.910 | 2.670 |
High resolution limit [Å] | 2.600 | 11.630 | 2.600 |
Rmerge | 0.073 | 0.023 | 1.439 |
Rmeas | 0.084 | 0.027 | 1.650 |
Total number of observations | 69528 | ||
Number of reflections | 17277 | 226 | 1276 |
<I/σ(I)> | 10.31 | 33.73 | 1.04 |
Completeness [%] | 92.8 | 96.6 | 94.7 |
Redundancy | 4.024 | 3.796 | 4.139 |
CC(1/2) | 0.999 | 1.000 | 0.747 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 298 | 2.0M ammonium sulfate, 0.1M BIS-Tris, pH 5.5 |