2IEJ
Human Protein Farnesyltransferase Complexed with Inhibitor Compound STN-48 And FPP Analog at 1.8A Resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-04-08 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.00 |
Spacegroup name | P 61 |
Unit cell lengths | 178.253, 178.253, 64.661 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 33.690 - 1.800 |
R-factor | 0.165 |
Rwork | 0.163 |
R-free | 0.18800 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.294 |
Data reduction software | HKL-2000 |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.900 | |
High resolution limit [Å] | 1.800 | 6.000 | 1.800 |
Rmerge | 0.041 | 0.018 | 0.271 |
Number of reflections | 107537 | ||
<I/σ(I)> | 22.72 | 59.6 | 3.7 |
Completeness [%] | 97.6 | 99.3 | 88.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.2 | crystallized via hanging drop against well solution containing 300 mM ammonium acetate pH 5.2, 12% PEG 8K , VAPOR DIFFUSION, HANGING DROP |