8IUV
Crystal structure of Manganese-free N(omega)-hydroxy-L-arginine hydrolase with oxidized Cys86
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-02-14 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9 |
| Spacegroup name | P 1 |
| Unit cell lengths | 45.876, 46.683, 58.222 |
| Unit cell angles | 85.39, 86.78, 70.54 |
Refinement procedure
| Resolution | 43.920 - 1.750 |
| R-factor | 0.16 |
| Rwork | 0.158 |
| R-free | 0.20080 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.894 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASES |
| Refinement software | PHENIX ((1.17.1_3660: 000)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.920 | 1.780 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.078 | 0.351 |
| Rmeas | 0.092 | 0.413 |
| Rpim | 0.048 | 0.217 |
| Total number of observations | 158923 | 8413 |
| Number of reflections | 44308 | 2372 |
| <I/σ(I)> | 9.8 | 3.1 |
| Completeness [%] | 96.8 | |
| Redundancy | 3.6 | 3.5 |
| CC(1/2) | 0.994 | 0.884 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.3 | 298 | PEG 4000, MgCl2 |
