3PX8
RTA in complex with 7-carboxy-pterin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 5.0.3 |
| Synchrotron site | ALS |
| Beamline | 5.0.3 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-01-01 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9765 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.662, 67.567, 49.410 |
| Unit cell angles | 90.00, 112.78, 90.00 |
Refinement procedure
| Resolution | 45.560 - 1.290 |
| R-factor | 0.2076 |
| Rwork | 0.206 |
| R-free | 0.23320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.029 |
| RMSD bond angle | 2.283 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.310 |
| High resolution limit [Å] | 1.290 | 3.500 | 1.290 |
| Rmerge | 0.042 | 0.031 | 0.276 |
| Number of reflections | 61978 | ||
| <I/σ(I)> | 12.8 | ||
| Completeness [%] | 95.4 | 89.1 | 91.2 |
| Redundancy | 3.7 | 3.6 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | hanging drop | 8.9 | 277 | 4.1% PEG 8000, 75 mM Bicine pH 8.9, 10 mM 2-mercaptoethanol, 1 mM EDTA, hanging drop, temperature 277K |
