3FPF
Crystal Structure of MtNAS in complex with MTA and tNA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-04-21 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.97000 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 64.410, 68.740, 146.300 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.750 - 1.660 |
| R-factor | 0.2 |
| Rwork | 0.199 |
| R-free | 0.22900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3fpe |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.469 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.2.25) |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 44.766 | 44.770 | 1.750 |
| High resolution limit [Å] | 1.660 | 5.250 | 1.660 |
| Rmerge | 0.069 | 0.032 | 0.282 |
| Total number of observations | 8849 | 41475 | |
| Number of reflections | 76848 | ||
| <I/σ(I)> | 7.034 | 12.7 | 2.6 |
| Completeness [%] | 99.3 | 92.1 | 99.8 |
| Redundancy | 3.8 | 3.7 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 294 | 22% PEG 3350, 400mM NaBr, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 294K |
