1OOH
Complex of Drosophila odorant binding protein LUSH with butanol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 105 |
| Detector technology | CCD |
| Collection date | 2002-02-21 |
| Detector | SBC-1 |
| Wavelength(s) | 0.97895 |
| Spacegroup name | P 43 |
| Unit cell lengths | 46.938, 46.938, 111.328 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 1.250 |
| R-factor | 0.16294 |
| Rwork | 0.160 |
| R-free | 0.18500 * |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1oof |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.315 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | REFMAC (5.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.290 |
| High resolution limit [Å] | 1.250 | 1.250 |
| Rmerge | 0.043 | 0.172 |
| Total number of observations | 196015 * | |
| Number of reflections | 64084 | |
| <I/σ(I)> | 21.8 | 2.8 |
| Completeness [%] | 96.7 | 89.4 |
| Redundancy | 3.1 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 4 * | 4 or 18 * | PEG 4000, sodium acetate, n-butanol, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | sodium acetate | 100 (mM) | pH4.0 |
| 2 | 1 | reservoir | PEG4000 | 25-30 (%(w/v)) | |
| 3 | 1 | reservoir | alcohol | 0.3 (%(v/v)) |
