4LH5
Dual inhibition of HIV-1 replication by Integrase-LEDGF allosteric inhibitors is predominant at post-integration stage during virus production rather than at integration
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-06-10 |
| Detector | PILATUS 2M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 72.938, 72.938, 65.881 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 45.590 - 2.190 |
| R-factor | 0.18067 |
| Rwork | 0.178 |
| R-free | 0.23625 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4lh4 |
| RMSD bond length | 0.020 |
| RMSD bond angle | 2.614 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.590 | 2.250 |
| High resolution limit [Å] | 2.190 | 2.190 |
| Rmerge | 0.029 | 0.123 |
| Number of reflections | 10071 | |
| <I/σ(I)> | 8.96 | |
| Completeness [%] | 97.6 | 93.4 |
| Redundancy | 3.33 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 297 | 1.16-1.36 M ammonium sulfate, 50 mM sodium cacodylate-HCl pH6.5, VAPOR DIFFUSION, HANGING DROP, temperature 297K |
