5QBO
Crystal structure of Endothiapepsin-NAT17-347283 complex
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 | 2014-12-18 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.918 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.361, 72.842, 52.560 |
| Unit cell angles | 90.00, 109.35, 90.00 |
Refinement procedure
| Resolution | 40.992 - 1.123 |
| R-factor | 0.1241 |
| Rwork | 0.124 |
| R-free | 0.14660 |
| Structure solution method | Rigid Body |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.237 |
| Data scaling software | XSCALE |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 40.992 | 40.992 | 1.190 |
| High resolution limit [Å] | 1.120 | 3.360 | 1.120 |
| Rmerge | 0.046 | 0.016 | 0.599 |
| Rmeas | 0.053 | 0.018 | 0.704 |
| Total number of observations | 449507 | ||
| Number of reflections | 121970 | 4666 | 19427 |
| <I/σ(I)> | 14.8 | 69.48 | 1.96 |
| Completeness [%] | 99.4 | 99.2 | 98.2 |
| CC(1/2) | 1.000 | 0.999 | 0.708 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 293 | 0.1 M ammonium acetate, 0.1 M sodium acetate, 24-30% PEG 4000; crystals obtained by streak-seeding |
