3TAM
Crystal structure of HIV-1 reverse transcriptase (K103N mutant) in complex with inhibitor M06
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.2 |
Synchrotron site | ALS |
Beamline | 5.0.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-01-27 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 117.910, 153.900, 155.690 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 16.580 - 2.510 |
R-factor | 0.196 |
Rwork | 0.193 |
R-free | 0.24900 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 3lp1 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.250 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | BUSTER (2.9.4) |
Refinement software | BUSTER (2.9.4) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 2.510 |
Rmerge | 0.080 |
Number of reflections | 42589 |
<I/σ(I)> | 16.5 |
Completeness [%] | 87.4 |
Redundancy | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.1 | 298 | sodium citrate, pH 6.1, VAPOR DIFFUSION, HANGING DROP, temperature 298K |