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 |