3BI4
Crystal structures of fms1 in complex with its inhibitors
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE F1 |
| Synchrotron site | CHESS |
| Beamline | F1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-06-03 |
| Detector | ADSC QUANTUM 210 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 161.589, 102.852, 76.647 |
| Unit cell angles | 90.00, 94.37, 90.00 |
Refinement procedure
| Resolution | 32.000 - 2.200 |
| Rwork | 0.227 |
| R-free | 0.26500 |
| Starting model (for MR) | native fms1 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 22.600 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.620 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.056 | 0.546 |
| Number of reflections | 95615 | |
| Completeness [%] | 97.4 | 94.5 |
| Redundancy | 3.7 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 295 | 10%PEG3350, 200mM CaCl2, 100mM Tris-HCl, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
