3LIY
crystal structure of HTLV protease complexed with Statine-containing peptide inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-01-01 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 133.690, 77.395, 80.166 |
| Unit cell angles | 90.00, 99.69, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.860 |
| R-factor | 0.18896 |
| Rwork | 0.188 |
| R-free | 0.22195 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 2b7f |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.345 |
| Data reduction software | HKL-3000 |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC (5.5.0104) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.960 |
| High resolution limit [Å] | 1.860 | 1.860 |
| Number of reflections | 66670 | |
| <I/σ(I)> | 22.1 | 2.5 |
| Completeness [%] | 98.5 | 89.1 |
| Redundancy | 3.7 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.2 | 293 | 17% PEG8000, 16% PEG300 and 10mM DTT, pH 5.2, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
