2PUM
Crystal structure of bovine lactoperoxidase complex with catechol and iodide at 2.7 A resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU300 |
| Temperature [K] | 292 |
| Detector technology | IMAGE PLATE |
| Collection date | 2007-03-05 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.54132 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.422, 80.489, 77.321 |
| Unit cell angles | 90.00, 102.60, 90.00 |
Refinement procedure
| Resolution | 24.930 - 2.700 |
| R-factor | 0.1666 |
| Rwork | 0.165 |
| R-free | 0.20283 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2nqx |
| RMSD bond length | 0.016 |
| RMSD bond angle | 2.046 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 74.540 | 2.800 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Number of reflections | 16961 | |
| Completeness [%] | 99.4 | 97.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 298 | Tris-HCl, Ammonium Iodide, Catechol, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
