6H8D
MamM CTD D249N - Nickel form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-02-01 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.975 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 36.852, 94.329, 53.355 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.160 - 1.620 |
| R-factor | 0.17502 |
| Rwork | 0.173 |
| R-free | 0.21357 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3w5x |
| RMSD bond length | 0.028 |
| RMSD bond angle | 2.558 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.160 | 1.640 |
| High resolution limit [Å] | 1.620 | 1.620 |
| Rmerge | 0.033 | |
| Number of reflections | 12238 | |
| <I/σ(I)> | 23.2 | 1.6 |
| Completeness [%] | 99.7 | 94.4 |
| Redundancy | 6.4 | 6 |
| CC(1/2) | 0.999 | 0.828 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2M Li2SO4, 0.1M BIS-TRIS pH=5.5, 25% PEG 3350, 1.7mM NiCl2 |
