2OWT
Crystal structure of Bordetella pertussis holo ferric binding protein with bound synergistic carbonate anion
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL1-5 |
| Synchrotron site | SSRL |
| Beamline | BL1-5 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-02-07 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.97944 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 54.674, 57.278, 87.927 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.000 - 2.400 |
| R-factor | 0.17811 |
| Rwork | 0.175 |
| R-free | 0.24228 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.220 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.490 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.069 | 0.276 |
| Number of reflections | 10839 | |
| <I/σ(I)> | 26.9 | 9.9 |
| Completeness [%] | 95.6 | 96.7 |
| Redundancy | 25.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9 | 294.15 | 34% PEG 1500, 0.1M Tris-HCl, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 294.15K |
