7P0P
NAF-1 bound to M1 molecule
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE MASSIF-1 |
| Synchrotron site | ESRF |
| Beamline | MASSIF-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-05-07 |
| Detector | DECTRIS PILATUS3 2M |
| Wavelength(s) | 0.9655 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 43.573, 47.589, 125.948 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.210 - 1.740 |
| R-factor | 0.206 |
| Rwork | 0.204 |
| R-free | 0.25400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3fnv |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.964 |
| Data reduction software | MOSFLM |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.590 | 1.770 |
| High resolution limit [Å] | 1.740 | 1.740 |
| Number of reflections | 27507 | 1487 |
| <I/σ(I)> | 8.8 | |
| Completeness [%] | 99.4 | |
| Redundancy | 4.6 | |
| CC(1/2) | 0.994 | 0.381 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 32% PEG-3000, 100 mM Tris-HCl (pH 8.0), 100mM NaCl. |
