5WA3
Pyridine synthase, TbtD, from thiomuracin biosynthesis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-06-13 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97857 |
| Spacegroup name | H 3 |
| Unit cell lengths | 155.830, 155.830, 165.239 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 104.520 - 2.800 |
| R-factor | 0.19967 |
| Rwork | 0.197 |
| R-free | 0.24167 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5w98 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.870 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 55.080 |
| High resolution limit [Å] | 2.800 |
| Rmerge | 0.117 |
| Number of reflections | 34569 |
| <I/σ(I)> | 10 |
| Completeness [%] | 93.9 |
| Redundancy | 6.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 289 | 0.4 M NaH2PO4, 1 M KH2PO4 pH 6.5 |
