1IKY
HIV-1 Reverse Transcriptase in Complex with the Inhibitor MSC194
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 279 |
| Detector technology | IMAGE PLATE |
| Collection date | 1999-07-11 |
| Detector | MARRESEARCH |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 120.340, 156.540, 156.470 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.780 - 3.000 |
| R-factor | 0.208 * |
| Rwork | 0.214 |
| R-free | 0.27300 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.400 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.750 | 3.080 |
| High resolution limit [Å] | 2.940 | 2.930 |
| Rmerge | 0.114 | 0.219 |
| Total number of observations | 261528 * | |
| Number of reflections | 27395 | 1170 * |
| <I/σ(I)> | 5.7 | |
| Completeness [%] | 85.9 | 73.6 * |
| Redundancy | 5.8 | 1.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 7.2 | 294 | Ammonium Sulphate, Potassium chloride, HEPES, Magnesium Chloride, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 294K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 20 (mg/ml) | |
| 2 | 1 | drop | DMSO | 30 (mM) | |
| 3 | 1 | reservoir | ammonium sulfate | 1.4 (M) | |
| 4 | 1 | reservoir | HEPES | 50 (mM) | pH7.2 |
| 5 | 1 | reservoir | 5 (mM) | ||
| 6 | 1 | reservoir | 300 (mM) |
