9JU4
Crystal structure of the Thermotoga maritima cold shock protein mutant Est#13 in complex with AacEst
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL41XU |
| Synchrotron site | SPring-8 |
| Beamline | BL41XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-07-20 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 2 1 |
| Unit cell lengths | 45.820, 46.650, 101.260 |
| Unit cell angles | 90.00, 93.99, 90.00 |
Refinement procedure
| Resolution | 46.650 - 2.000 |
| R-factor | 0.1707 |
| Rwork | 0.170 |
| R-free | 0.20700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.873 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.17.1_3660: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.650 | 1.610 |
| High resolution limit [Å] | 1.520 | 1.520 |
| Number of reflections | 28793 | 10348 |
| <I/σ(I)> | 11.13 | |
| Completeness [%] | 99.2 | |
| Redundancy | 4.38 | |
| CC(1/2) | 0.999 | 0.540 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5 | 292 | 0.1 M sodium citrate, pH 5.0, and 20% (W/V) PEG8000 |
