1NM0
Proteus mirabilis catalase in complex with formiate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | AREA DETECTOR |
Detector | MARRESEARCH |
Wavelength(s) | 0.98 |
Spacegroup name | P 62 2 2 |
Unit cell lengths | 110.000, 110.000, 250.000 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 14.980 - 2.300 |
R-factor | 0.181 |
Rwork | 0.181 |
R-free | 0.21100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB ID 1M85 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.400 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.400 |
High resolution limit [Å] | 2.300 | 2.300 |
Number of reflections | 39651 | |
<I/σ(I)> | 6.9 | 3.5 |
Completeness [%] | 98.1 | 99.1 |
Redundancy | 7.4 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | ammonium sulfate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |