1H4T
Prolyl-tRNA synthetase from Thermus thermophilus complexed with L-proline
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM1A |
Synchrotron site | ESRF |
Beamline | BM1A |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 1996-12-15 |
Detector | MARRESEARCH |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 132.570, 193.470, 125.240 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 15.000 - 2.900 |
R-factor | 0.2 |
Rwork | 0.200 |
R-free | 0.24300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1HC7 (LIGAND FREE PROLYL-TRNA SYNTHETASE) |
RMSD bond length | 0.006 |
RMSD bond angle | 1.310 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.000 | 2.970 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.068 | 0.223 |
Total number of observations | 284962 * | |
Number of reflections | 71108 | |
<I/σ(I)> | 3.3 | |
Completeness [%] | 99.0 | 99.9 |
Redundancy | 4 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.9 | SEE REFERENCE 2, pH 7.90 |