5E7Q
Acyl-CoA synthetase PtmA2 from Streptomyces platensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-08-19 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 70.872, 146.892, 146.928 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.300 - 2.230 |
| R-factor | 0.1748 |
| Rwork | 0.173 |
| R-free | 0.20600 |
| Structure solution method | SAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.403 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.270 |
| High resolution limit [Å] | 2.230 | 6.050 | 2.230 |
| Rmerge | 0.094 | 0.054 | 0.701 |
| Rmeas | 0.103 | 0.059 | 0.806 |
| Rpim | 0.041 | 0.024 | 0.389 |
| Total number of observations | 462242 | ||
| Number of reflections | 75465 | ||
| <I/σ(I)> | 9.4 | 1.95 | |
| Completeness [%] | 100.0 | 99.9 | 99.9 |
| Redundancy | 6.1 | 5.9 | 4.1 |
| CC(1/2) | 0.998 | 0.697 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 289 | 1.6 M magnesium sulfate, 0.1 M MES buffer |
