4N2S
Crystal Structure of THA8 in complex with Zm1a-6 RNA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-03-22 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | .97872 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 88.250, 88.250, 78.927 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 3.000 |
| R-factor | 0.20651 |
| Rwork | 0.205 |
| R-free | 0.23151 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | THA8 Apo structure |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.077 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.160 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.114 | 1.190 |
| Number of reflections | 6677 | |
| <I/σ(I)> | 19.2 | 2.2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 10.2 | 10.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 295 | 14% PEG 4000 and 0.1 M MES, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 295K |
