7WNN
Crystal structure of Imine Reductase from Actinoalloteichus hymeniacidonis in complex with NADPH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-10-08 |
| Detector | DECTRIS EIGER2 S 9M |
| Wavelength(s) | 0.97911 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 126.523, 60.676, 91.396 |
| Unit cell angles | 90.00, 92.96, 90.00 |
Refinement procedure
| Resolution | 30.420 - 1.530 |
| R-factor | 0.1758 |
| Rwork | 0.175 |
| R-free | 0.19880 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.964 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | RESOLVE |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.420 | 1.580 |
| High resolution limit [Å] | 1.530 | 1.533 |
| Rmerge | 0.522 | |
| Number of reflections | 98269 | 7529 |
| <I/σ(I)> | 18.21 | 2.24 |
| Completeness [%] | 89.3 | 72.69 |
| Redundancy | 4.6 | 3.6 |
| CC(1/2) | 0.999 | 0.802 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 291.15 | 0.25M ammonium sulfate, 0.1M MES buffer (pH 6.0), 25% w/v PEG 4000 |
