2NWW
Crystal structure of GltPh in complex with TBOA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.2 |
| Synchrotron site | ALS |
| Beamline | 8.2.2 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.978 |
| Spacegroup name | P 61 |
| Unit cell lengths | 115.245, 115.245, 322.372 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 100.000 - 3.200 |
| R-factor | 0.242 |
| Rwork | 0.241 |
| R-free | 0.26000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1xfh |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.204 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.000 | 3.550 |
| High resolution limit [Å] | 3.200 | 3.400 |
| Rmerge | 0.079 | 0.396 |
| Number of reflections | 29939 | |
| <I/σ(I)> | 21.3 | 2.2 |
| Completeness [%] | 82.3 | 33.2 |
| Redundancy | 6.1 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 277 | pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
