2Z1N
Crystal structure of APE0912 from Aeropyrum pernix K1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW12A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 110.759, 68.869, 69.340 |
| Unit cell angles | 90.00, 119.00, 90.00 |
Refinement procedure
| Resolution | 31.190 - 1.800 |
| R-factor | 0.18882 |
| Rwork | 0.186 |
| R-free | 0.23732 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1o5i |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.513 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.660 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.032 | 0.490 |
| Number of reflections | 60040 | |
| <I/σ(I)> | 33.1 | 3.1 |
| Completeness [%] | 95.1 | 79.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.4 | 293 | 2.5% PEG 8000, 0.05M Tris-HCl, 0.025M MES-NaOH, 0.1M Sodium chloride, 2.5mM NADPH, pH 8.4, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
