3HHA
Crystal structure of cathepsin L in complex with AZ12878478
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2007-10-28 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 |
| Unit cell lengths | 57.260, 62.690, 68.240 |
| Unit cell angles | 105.60, 93.22, 115.55 |
Refinement procedure
| Resolution | 44.280 - 1.270 |
| R-factor | 0.11812 |
| Rwork | 0.116 |
| R-free | 0.15237 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.355 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.280 | 1.330 |
| High resolution limit [Å] | 1.270 | 1.270 |
| Rmerge | 0.034 | 0.098 |
| Number of reflections | 182842 | |
| Completeness [%] | 85.6 | 65.8 |
| Redundancy | 1.5 | 0.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.4 | 293 | PEG, pH 7.4, VAPOR DIFFUSION, temperature 293K |
