5JL4
Inhibitor resistant mutant catalytic core domain of HIV-1 Integrase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-003 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-08-13 |
Detector | DECTRIS PILATUS 200K |
Wavelength(s) | 1.514 |
Spacegroup name | P 1 |
Unit cell lengths | 45.192, 45.346, 49.040 |
Unit cell angles | 63.96, 68.05, 62.43 |
Refinement procedure
Resolution | 43.037 - 1.758 |
R-factor | 0.1613 |
Rwork | 0.159 |
R-free | 0.19180 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1itg |
RMSD bond length | 0.010 |
RMSD bond angle | 0.945 |
Data reduction software | HKL-3000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 43.037 |
High resolution limit [Å] | 1.758 |
Rmerge | 0.056 |
Number of reflections | 29637 |
<I/σ(I)> | 32.7 |
Completeness [%] | 98.3 |
Redundancy | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277.5 | .2M Ammonium Sulfate 0.1 M BIS-TRIS pH 5.5 25% w/v Polyethylene glycol 3,350 |