6WT2
Crystal Structure of Putative NAD(P)H-Flavin Oxidoreductase from Neisseria meningitidis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-11-25 |
| Detector | DECTRIS PILATUS3 X 6M |
| Wavelength(s) | 0.97951 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 81.556, 70.167, 85.624 |
| Unit cell angles | 90.00, 89.96, 90.00 |
Refinement procedure
| Resolution | 45.170 - 1.750 |
| R-factor | 0.1939 |
| Rwork | 0.193 |
| R-free | 0.21830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2hay |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.827 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.780 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.188 | |
| Number of reflections | 96271 | 4791 |
| <I/σ(I)> | 11.3 | 1.12 |
| Completeness [%] | 99.3 | 98.9 |
| Redundancy | 5 | 4 |
| CC(1/2) | 0.964 | 0.616 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 289 | 0.2 M calcium chloride, 0.1 M Tris, pH 8.5, 25% w/v PEG4000 |
