6SCY
U34-tRNA thiolase NcsA from Methanococcus maripaludis with its [4Fe-4S] cluster
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 2 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-12-07 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.980096 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 54.980, 84.480, 145.440 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 31.850 - 2.810 |
| R-factor | 0.213 |
| Rwork | 0.209 |
| R-free | 0.28700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3vrh |
| Data reduction software | XDS (20170615) |
| Data scaling software | XDS (20170615) |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.480 | 2.860 |
| High resolution limit [Å] | 2.790 | 2.790 |
| Rmerge | 0.183 | 6.890 |
| Rmeas | 0.194 | 7.304 |
| Rpim | 0.088 | 2.366 |
| Number of reflections | 17385 | 1150 |
| <I/σ(I)> | 7.5 | 0.3 |
| Completeness [%] | 99.3 | 91.5 |
| Redundancy | 9 | 9 |
| CC(1/2) | 0.997 | 0.146 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 292.15 | anaerobic conditions (glove box). 0.1M HEPES pH 7.5, 0.2 M ammonium sulfate, 18% (w/v) PEG 4000, 10% isopropanol |
