1DAB
The Structure of Bordetella Pertussis Virulence Factor P.69 Pertactin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX9.6 |
| Synchrotron site | SRS |
| Beamline | PX9.6 |
| Temperature [K] | 98 |
| Detector technology | IMAGE PLATE |
| Collection date | 1995-04-21 |
| Detector | MARRESEARCH |
| Spacegroup name | P 63 2 2 |
| Unit cell lengths | 176.199, 176.199, 104.688 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 2.500 |
| R-factor | 0.25001 |
| Rwork | 0.250 |
| R-free | 0.27562 |
| RMSD bond length | 0.070 |
| RMSD bond angle | 0.030 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | DM |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.570 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.068 | 0.382 |
| Number of reflections | 40028 | |
| <I/σ(I)> | 9.7 | |
| Completeness [%] | 99.4 | 99.2 |
| Redundancy | 4.8 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 8.8 | 298 | Emsley, P., (1994) J. Mol. Biol., 235, 772. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 9 (mg/ml) | |
| 2 | 1 | drop | Tris-HCl | 50 (mM) | |
| 3 | 1 | drop | 150 (mM) | ||
| 4 | 1 | reservoir | ammonium sulfate | 28 (%sat) | |
| 5 | 1 | reservoir | Tris-HCl | 100 (mM) |
