5UAX
Structure of apo human PYCR-1 crystallized in space group C2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 4.2.2 |
Synchrotron site | ALS |
Beamline | 4.2.2 |
Temperature [K] | 100 |
Detector technology | CMOS |
Collection date | 2015-10-18 |
Detector | RDI CMOS_8M |
Wavelength(s) | 1.00 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 183.850, 120.690, 88.140 |
Unit cell angles | 90.00, 109.25, 90.00 |
Refinement procedure
Resolution | 60.345 - 1.850 |
R-factor | 0.1738 |
Rwork | 0.172 |
R-free | 0.19960 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2izz |
RMSD bond length | 0.014 |
RMSD bond angle | 1.273 |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.15) |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 60.345 | 60.340 | 1.880 |
High resolution limit [Å] | 1.850 | 10.130 | 1.850 |
Rmerge | 0.055 | 0.028 | 0.672 |
Number of reflections | 153414 | ||
<I/σ(I)> | 16.1 | ||
Completeness [%] | 99.3 | 96.8 | 95.9 |
Redundancy | 4.4 | 6.3 | 2.9 |
CC(1/2) | 0.999 | 0.999 | 0.688 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 3 M NaCl and 0.1 M HEPES at pH 7.5-8.0 |