2ZIR
Crystal Structure of rat protein farnesyltransferase complexed with a benzofuran inhibitor and FPP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-6B |
Synchrotron site | Photon Factory |
Beamline | BL-6B |
Temperature [K] | 100 |
Detector technology | DIFFRACTOMETER |
Collection date | 2001-06-05 |
Detector | WEISSENBERG |
Wavelength(s) | 1.000 |
Spacegroup name | P 61 |
Unit cell lengths | 171.996, 171.996, 69.179 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 43.000 - 2.400 |
Rwork | 0.195 |
R-free | 0.23000 |
Structure solution method | MR |
Starting model (for MR) | 1fpp |
RMSD bond length | 0.006 |
RMSD bond angle | 1.329 |
Data reduction software | DENZO (1.9.0) |
Data scaling software | SCALEPACK (1.9.0) |
Phasing software | MOLREP (6.2.5) |
Refinement software | CNX (2000) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 100.000 | 100.000 | 2.490 |
High resolution limit [Å] | 2.400 | 5.170 | 2.400 |
Rmerge | 0.045 | 0.017 | 0.396 |
Number of reflections | 44027 | ||
<I/σ(I)> | 21.8 | ||
Completeness [%] | 95.9 | 98.6 | 86.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 277 | 20mg/ml protein, 0.5mM FPP, 1mM inhibitor, 10% PEG6000, 0.2M Mg acetate, 0.1M Na acetate buffer, pH4.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |