3TM5
Crystal structure of Trm14 from Pyrococcus furiosus in complex with sinefungin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-02-05 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.98000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 82.245, 45.064, 121.082 |
| Unit cell angles | 90.00, 91.81, 90.00 |
Refinement procedure
| Resolution | 48.020 - 2.270 |
| R-factor | 0.20474 |
| Rwork | 0.204 |
| R-free | 0.21892 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3tlj |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.610 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.400 |
| High resolution limit [Å] | 2.270 | 2.270 |
| Rmerge | 0.147 | 0.643 |
| Number of reflections | 55944 | |
| <I/σ(I)> | 8.6 | 2.08 |
| Completeness [%] | 98.7 | 92.8 |
| Redundancy | 3.8 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 100 mM Tris-acetate, 32% PEG 4000, 15% glycerol, crystal was soaked in crystallization solution containing 1 mM sinefungin, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
