9KE8
Crystal Structure of HdNadV and its complex with NMN
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 | 2022-01-12 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.979183 |
| Spacegroup name | P 65 |
| Unit cell lengths | 158.520, 158.520, 130.400 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 38.080 - 1.860 |
| R-factor | 0.2103 |
| Rwork | 0.209 |
| R-free | 0.23510 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.603 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.18.2_3874: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.080 | 1.927 |
| High resolution limit [Å] | 1.860 | 1.860 |
| Rmerge | 1.340 | |
| Number of reflections | 155560 | 155510 |
| <I/σ(I)> | 1.34 | |
| Completeness [%] | 99.9 | |
| Redundancy | 29.76 | |
| CC(1/2) | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 293.15 | 0.1 M trisodium citrate [pH 5.6] and 2.0 M ammonium sulfate |
