5OI5
Dissociation of biochemical and antiretroviral activities of Integrase-LEDGF Allosteric Inhibitors revealed by resistance of A125 polymorphic HIV-1
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 | 2013-03-20 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.0 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 73.219, 73.219, 65.998 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 36.610 - 2.400 |
R-factor | 0.21072 |
Rwork | 0.208 |
R-free | 0.26131 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4lh4 |
RMSD bond length | 0.016 |
RMSD bond angle | 1.838 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 36.610 |
High resolution limit [Å] | 2.010 |
Number of reflections | 23646 |
<I/σ(I)> | 11.6 |
Completeness [%] | 89.2 |
Redundancy | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 297 | Ammonium sulfate, cacodylate |