5AHU
T. Brucei Farnesyl Diphosphate Synthase Complexed with Bisphosphonate BPH-1326
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-17A |
| Synchrotron site | Photon Factory |
| Beamline | BL-17A |
| Temperature [K] | 298 |
| Detector technology | CCD |
| Collection date | 2013-12-15 |
| Detector | ADSC QUANTUM 270 |
| Spacegroup name | I 1 2 1 |
| Unit cell lengths | 63.010, 117.860, 123.724 |
| Unit cell angles | 90.00, 95.80, 90.00 |
Refinement procedure
| Resolution | 32.840 - 2.690 |
| R-factor | 0.18406 |
| Rwork | 0.181 |
| R-free | 0.23553 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2p1c |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.522 |
| Data reduction software | MOSFLM |
| Phasing software | CCP4 |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.290 | 2.840 |
| High resolution limit [Å] | 2.690 | 2.690 |
| Rmerge | 0.090 | 0.290 |
| Number of reflections | 23536 | |
| <I/σ(I)> | 8.7 | 3.7 |
| Completeness [%] | 94.3 | 94.9 |
| Redundancy | 3 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.75 | 298 | 6% MPD, 0.1 AMMONIUM ACETATE, PH 5.75, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K |
