5FAC
Alanine Racemase from Streptomyces coelicolor A3(2)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-01-28 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.972422 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 78.960, 87.170, 109.626 |
| Unit cell angles | 90.00, 102.26, 90.00 |
Refinement procedure
| Resolution | 47.780 - 2.800 |
| R-factor | 0.211 |
| Rwork | 0.208 |
| R-free | 0.25918 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1vfh |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.601 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.780 | 2.940 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.249 | |
| Number of reflections | 32860 | |
| <I/σ(I)> | 3.8 | 1.3 |
| Completeness [%] | 96.0 | 84.1 |
| Redundancy | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 0.1 M BIS-TRIS propane pH 8.5, 0.2 M NaBr, 20% (w/v) PEG3350 |
