5ZDQ
Crystal structure of cyanide-insensitive alternative oxidase from Trypanosoma brucei with COLLETOCHLORIN B
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-12-04 |
| Detector | RAYONIX MX225HE |
| Wavelength(s) | 0.9000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 228.017, 137.920, 63.058 |
| Unit cell angles | 90.00, 106.08, 90.00 |
Refinement procedure
| Resolution | 42.890 - 2.300 |
| R-factor | 0.18648 |
| Rwork | 0.185 |
| R-free | 0.21972 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3vv9 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.289 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.340 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.095 | 0.506 |
| Number of reflections | 82140 | 4112 |
| <I/σ(I)> | 7.7 | 2.6 |
| Completeness [%] | 99.0 | 99.6 |
| Redundancy | 3.3 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 293 | 30% PEG400, 0.1M IMIDAZOLE, 0.5M POTASSIUM FORMATE |
