8GXK
Pseudomonas jinjuensis N-acetyltransferase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-03-18 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9790 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.876, 100.687, 94.618 |
| Unit cell angles | 90.00, 96.20, 90.00 |
Refinement procedure
| Resolution | 33.430 - 1.780 |
| R-factor | 0.206 |
| Rwork | 0.205 |
| R-free | 0.24700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1yre |
| RMSD bond length | 0.015 |
| RMSD bond angle | 2.011 |
| Data reduction software | HKL-2000 (v1.0) |
| Data scaling software | HKL-2000 (v1.0) |
| Phasing software | PHENIX (1.13_2998) |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.430 | 1.840 |
| High resolution limit [Å] | 1.780 | 1.780 |
| Rmerge | 0.096 | 0.590 |
| Number of reflections | 75982 | 7475 |
| <I/σ(I)> | 21.8 | 1.9 |
| Completeness [%] | 99.8 | |
| Redundancy | 5.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.1M Tris-HCl pH8.5, 15%PEG6000, 0.2M NaCl |
