5ZW8
PigA with FAD and proline
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE TPS 05A |
Synchrotron site | NSRRC |
Beamline | TPS 05A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2018-04-30 |
Detector | RAYONIX MX300-HS |
Wavelength(s) | 1.0000 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 85.585, 85.558, 146.144 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 31.277 - 1.689 |
R-factor | 0.1549 |
Rwork | 0.154 |
R-free | 0.17980 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5zw2 |
RMSD bond length | 0.019 |
RMSD bond angle | 1.672 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 1.740 |
High resolution limit [Å] | 1.680 | 1.680 |
Rmerge | 0.090 | 0.741 |
Number of reflections | 59573 | 5885 |
<I/σ(I)> | 22.6 | 2.2 |
Completeness [%] | 99.8 | 99.4 |
Redundancy | 8 | 7.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 291 | 7mM L-proline, 1.9M sodium malonate |