5FKL
TetR(D) H100A mutant in complex with anhydrotetracycline 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 |
| Detector | RAYONIX SX-165mm |
| Spacegroup name | I 41 2 2 |
| Unit cell lengths | 66.557, 66.557, 179.681 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 62.020 - 1.900 |
| R-factor | 0.21695 |
| Rwork | 0.215 |
| R-free | 0.26545 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4d7m |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.150 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 62.000 | 1.930 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.050 | 0.670 |
| Number of reflections | 15800 | |
| <I/σ(I)> | 24.5 | 2.5 |
| Completeness [%] | 97.1 | 99.2 |
| Redundancy | 4.8 | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 295 | 0.4 M (NH4)2SO4, 0.7 M LI2SO4, 0.1 M SODIUM CITRATE, 1 MM 5A,6-ANHYDROTETRACYCLINE, 7.5 MM MGCL2 AT 295 K |
