4RO5
Crystal structure of the SAT domain from the non-reducing fungal polyketide synthase CazM
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 | 2013-12-08 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.94200 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 43.130, 52.160, 163.090 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 81.540 - 1.600 |
R-factor | 0.1884 |
Rwork | 0.187 |
R-free | 0.21530 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.059 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHELXCD |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 81.540 | 81.540 | 1.640 |
High resolution limit [Å] | 1.600 | 7.150 | 1.600 |
Rmerge | 0.047 | 0.021 | 0.264 |
Number of reflections | 48603 | 924 | 6112 |
<I/σ(I)> | 11.53 | 27.88 | 2.98 |
Completeness [%] | 92.7 | 86.7 | 88.1 |
Redundancy | 1.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277 | 100 mM Tris HCl pH 7 and 20% PEG 8000, vapor diffusion, hanging drop, temperature 277K |