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 |