2XPV
TetR(D) in complex with minocycline and magnesium.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X13 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X13 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-04-06 |
| Detector | MARRESEARCH SX-165 |
| Spacegroup name | I 41 2 2 |
| Unit cell lengths | 68.686, 68.686, 178.673 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 64.550 - 1.490 |
| R-factor | 0.18585 |
| Rwork | 0.185 |
| R-free | 0.20146 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2tct |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.692 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 64.550 | 1.520 |
| High resolution limit [Å] | 1.490 | 1.490 |
| Rmerge | 0.040 | 0.630 |
| Number of reflections | 32272 | |
| <I/σ(I)> | 32.1 | 2.1 |
| Completeness [%] | 95.9 | 92.6 |
| Redundancy | 3.9 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 12% PEG 6000, 2.0 M NACL, pH 8 |
