4Y4J
Endothiapepsin in complex with fragment B97
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-08-02 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.918409 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.225, 72.937, 52.663 |
| Unit cell angles | 90.00, 109.20, 90.00 |
Refinement procedure
| Resolution | 42.709 - 1.030 |
| R-factor | 0.1106 |
| Rwork | 0.110 |
| R-free | 0.12550 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.258 |
| Data reduction software | XDS |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.709 | 1.090 |
| High resolution limit [Å] | 1.030 | 1.030 |
| Rmerge | 0.481 | |
| Number of reflections | 148808 | |
| <I/σ(I)> | 13.56 | |
| Completeness [%] | 93.5 | 74.2 |
| Redundancy | 3.69 | 3.03 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 290 | 0.1 M ammonium acetate, 0.1 M sodium acetate, 24-30% PEG 4000, crystals obtained by streak seeding |
