8I5A
N-acetyl-(R)-beta-phenylalanine acylase, 2.75 angstrom resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-5A |
| Synchrotron site | Photon Factory |
| Beamline | BL-5A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-06-28 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 112.860, 112.860, 343.319 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.500 - 2.750 |
| R-factor | 0.1924 |
| Rwork | 0.191 |
| R-free | 0.24030 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.107 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.050 | 2.830 |
| High resolution limit [Å] | 2.750 | 2.750 |
| Rmeas | 0.127 | 0.943 |
| Number of reflections | 58819 | 4467 |
| <I/σ(I)> | 29.9 | 4.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 28.7 | 25.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M HEPES-NaOH pH 7.73, 2.0-2.7 M ammonium formate |
