9URK
Crystal structure of Imine Reductase Mutant(AHtanRedAm) from Actinoalloteichus hymeniacidonis in complex with NADPH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL02U1 |
| Synchrotron site | SSRF |
| Beamline | BL02U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-06-26 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.979 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 109.615, 68.047, 95.161 |
| Unit cell angles | 90.00, 96.75, 90.00 |
Refinement procedure
| Resolution | 32.020 - 2.200 |
| R-factor | 0.2007 |
| Rwork | 0.199 |
| R-free | 0.23460 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.684 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.15.1_3469) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.020 | 2.279 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.892 | 0.919 |
| Number of reflections | 32761 | 3327 |
| <I/σ(I)> | 9.72 | |
| Completeness [%] | 92.2 | |
| Redundancy | 4.5 | |
| CC(1/2) | 0.997 | 0.625 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 6% v/v Tacsimate pH 6.0, 0.1 M MES monohydrate pH 5.5, 21% w/v Polyethylene glycol 4,000 |
