6LYA
PylRS C-terminus domain mutant bound with 1-Methyl-L-tryptophan and AMPNP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL32XU |
| Synchrotron site | SPring-8 |
| Beamline | BL32XU |
| Temperature [K] | 110 |
| Detector technology | PIXEL |
| Collection date | 2017-11-17 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 64 |
| Unit cell lengths | 105.450, 105.450, 71.824 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 42.502 - 1.591 |
| R-factor | 0.178800562783 |
| Rwork | 0.178 |
| R-free | 0.19419 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2zce |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.192 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.680 | 1.650 |
| High resolution limit [Å] | 1.590 | 1.590 |
| Rmeas | 0.073 | 1.232 |
| Rpim | 0.025 | 0.410 |
| Number of reflections | 60796 | 5945 |
| <I/σ(I)> | 15.5 | |
| Completeness [%] | 99.8 | |
| Redundancy | 8.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 100 mM HEPES, 10% PEG 8000, 10% Ethylene Glycerol |
