1HQU
HUMAN IMMUNODEFICIENCY VIRUS TYPE 1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE F1 |
| Synchrotron site | CHESS |
| Beamline | F1 |
| Temperature [K] | 108 |
| Detector technology | CCD |
| Collection date | 1997-01-28 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.91 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 223.900, 68.900, 103.900 |
| Unit cell angles | 90.00, 106.40, 90.00 |
Refinement procedure
| Resolution | 25.000 - 2.700 |
| R-factor | 0.249 * |
| Rwork | 0.249 |
| R-free | 0.34500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1bqm |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.700 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | X-PLOR |
| Refinement software | X-PLOR (3.843) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.750 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.153 | 0.468 * |
| Total number of observations | 313409 * | |
| Number of reflections | 35562 * | |
| <I/σ(I)> | 6.7 | |
| Completeness [%] | 94.4 * | 52.7 * |
| Redundancy | 8.3 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 * | 277 | used microseeding * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | NNRTI | 20 (mM) | |
| 10 | 1 | reservoir | PEG8000 | 9 (%(w/v)) | |
| 2 | 1 | drop | beta-OG | 5 (%(w/v)) | |
| 3 | 1 | drop | protein | 30 (mg/ml) | |
| 4 | 1 | drop | Tris-HCl | 10 (mM) | |
| 5 | 1 | drop | 75 (mM) | ||
| 6 | 1 | reservoir | bis-Tris-propane | 50 (mM) | |
| 7 | 1 | reservoir | ammonium sulfate | 100 (mM) | |
| 8 | 1 | reservoir | glycerol | 10 | |
| 9 | 1 | drop | DMSO |
