3LKF
LEUKOCIDIN F (HLGB) FROM STAPHYLOCOCCUS AUREUS WITH PHOSPHOCHOLINE BOUND
Experimental procedure
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 14-BM-D |
| Synchrotron site | APS |
| Beamline | 14-BM-D |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 1998-06 |
| Detector | ADSC |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 39.970, 48.600, 148.060 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 6.000 - 1.900 |
| R-factor | 0.199 |
| Rwork | 0.199 |
| R-free | 0.25400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PREVIOUSLY DETERMINED STRUCTURE |
| RMSD bond length | 0.010 |
| RMSD bond angle | 28.176 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | X-PLOR (3.851) |
| Refinement software | X-PLOR (3.851) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.049 * | 0.176 * |
| Number of reflections | 26850 | |
| Completeness [%] | 97.2 | 86 |
| Redundancy | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 7.5 * | 20 * | pH 8.5 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | PEG3000 | 25-30 (%(w/v)) | |
| 2 | 1 | reservoir | Tris | 0.1 (M) | |
| 3 | 1 | drop | protein | 4-10 (mg/ml) | |
| 4 | 1 | drop | HEPES | 30 (mM) | |
| 5 | 1 | drop | 80 (mM) |
