1H7K
Formation of a tyrosyl radical intermediate in Proteus mirabilis catalase by directed mutagenesis and consequences for nucleotide reactivity
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-07-15 |
| Detector | MARRESEARCH |
| Spacegroup name | P 62 2 2 |
| Unit cell lengths | 110.000, 110.000, 251.200 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 15.000 * - 2.400 |
| R-factor | 0.237 |
| Rwork | 0.237 |
| R-free | 0.24000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1CAE |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.500 * |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | CNS |
| Refinement software | CNS (1.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.260 | 2.050 |
| High resolution limit [Å] | 2.400 | 2.000 |
| Rmerge | 0.080 * | 0.251 * |
| Number of reflections | 35932 | |
| Completeness [%] | 99.7 | 99.9 * |
| Redundancy | 15.8 | 4.8 * |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 * | 4-5 * | Jouve, H.M., (1991) J.Mol.Biol., 221, 1075. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 27 (mg/ml) | |
| 2 | 1 | drop | Tris-HCl | 100 (mM) | |
| 3 | 1 | drop | glycerol | 2.5 (%(v/v)) | |
| 4 | 1 | drop | ammonium sulfate | 1 (M) | |
| 5 | 1 | drop | 25 (mM) | ||
| 6 | 1 | reservoir | ammonium sulfate | 2 (M) | |
| 7 | 1 | reservoir | 50 (mM) | ||
| 8 | 1 | reservoir | Tris-HCl | 100 (mM) |
