3A2N
Crystal structure of DBJA (Wild Type Type II P21)
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 |
| Collection date | 2006-10-20 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 125.534, 47.766, 99.410 |
| Unit cell angles | 90.00, 93.61, 90.00 |
Refinement procedure
| Resolution | 32.810 - 1.890 |
| R-factor | 0.19331 |
| Rwork | 0.192 |
| R-free | 0.22783 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3a2m |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.333 |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.960 |
| High resolution limit [Å] | 1.890 | 1.890 |
| Rmerge | 0.063 | |
| Number of reflections | 94042 | |
| Completeness [%] | 99.5 | |
| Redundancy | 4.8 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.9 | 293 | PEG 4000, PH 7.9, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K |
