2V6U
High resolution crystal structure of pterin-4a-carbinolamine dehydratase from Toxoplasma gondii
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-09-17 |
| Detector | ADSC CCD |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 120.135, 120.135, 49.773 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 53.760 - 1.600 |
| R-factor | 0.173 |
| Rwork | 0.172 |
| R-free | 0.19400 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 2v6s |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.948 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 53.800 | 1.690 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.070 | 0.480 |
| Number of reflections | 47707 | |
| <I/σ(I)> | 27.8 | 5.8 |
| Completeness [%] | 100.0 | 97.9 |
| Redundancy | 9.2 | 14.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.6 | 1.4 M AMMONIUM SULPHATE, 1 M LITHIUM SULPHATE, pH 7.6 |
