5EUO
PF6-M1-HLA-A2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 80 |
Detector technology | CCD |
Collection date | 2015-11-08 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 134.744, 54.082, 149.296 |
Unit cell angles | 90.00, 116.61, 90.00 |
Refinement procedure
Resolution | 120.472 - 2.100 |
R-factor | 0.2302 |
Rwork | 0.229 |
R-free | 0.28060 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1oga |
RMSD bond length | 0.009 |
RMSD bond angle | 1.203 |
Data reduction software | HKL-2000 |
Data scaling software | Aimless |
Phasing software | PHASER (2.5.6) |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 133.480 | 133.480 | 2.140 |
High resolution limit [Å] | 2.100 | 11.500 | 2.100 |
Rmerge | 0.144 | 0.033 | 1.757 |
Rpim | 0.057 | 0.014 | 0.683 |
Total number of observations | 844017 | 4819 | 41546 |
Number of reflections | 113120 | ||
<I/σ(I)> | 11.7 | 42.3 | 1.2 |
Completeness [%] | 100.0 | 96.5 | 99.9 |
Redundancy | 7.5 | 6.5 | 7.5 |
CC(1/2) | 0.998 | 0.999 | 0.543 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | PEG3350, Imidazole |