2J9Y
Tryptophan Synthase Q114N mutant in complex with Compound II
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-03-12 |
| Detector | MARRESEARCH |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 182.740, 60.700, 67.410 |
| Unit cell angles | 90.00, 94.83, 90.00 |
Refinement procedure
| Resolution | 19.450 - 1.800 |
| R-factor | 0.228 |
| Rwork | 0.228 |
| R-free | 0.26300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.123 |
| RMSD bond angle | 1.800 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.900 |
| High resolution limit [Å] | 1.700 | 1.800 |
| Rmerge | 0.090 | 0.340 |
| Number of reflections | 80056 | |
| <I/σ(I)> | 9 | 3.8 |
| Completeness [%] | 98.7 | 98.8 |
| Redundancy | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.8 | pH 7.8 |
