5UPR
X-ray structure of a putative triosephosphate isomerase from Toxoplasma gondii ME49
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-10-27 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97875 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 56.368, 115.533, 78.719 |
| Unit cell angles | 90.00, 90.02, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.000 |
| R-factor | 0.16784 |
| Rwork | 0.166 |
| R-free | 0.20794 |
| Structure solution method | SAD |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.812 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.030 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.100 | 0.650 |
| Number of reflections | 67710 | 3393 |
| <I/σ(I)> | 15.04 | 2.86 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 3.9 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | 0.2 M Ammonium Sulphate, 0.1 M Bis-Tris, 25 % PEG3350 |
