3KDM
Crystal Structure of Human Anti-steroid Fab 5F2 in Complex with Testosterone
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-04-14 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0091 |
| Spacegroup name | P 1 |
| Unit cell lengths | 66.750, 67.080, 67.060 |
| Unit cell angles | 81.32, 69.30, 69.27 |
Refinement procedure
| Resolution | 48.250 - 1.500 |
| R-factor | 0.181 |
| Rwork | 0.180 |
| R-free | 0.20800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1mhp |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.658 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.600 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.033 | 0.321 |
| Number of reflections | 151891 | |
| <I/σ(I)> | 2.47 | |
| Completeness [%] | 93.1 | 91 |
| Redundancy | 2 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.7 | 293 | 12% PEG 3350, 0.1M sodium citrate, pH 4.7, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
