6GMV
MamM CTD - Nickel form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-06-29 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.977999 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 37.340, 94.479, 53.689 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.240 - 1.590 |
| R-factor | 0.1899 |
| Rwork | 0.188 |
| R-free | 0.22180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3w5x |
| RMSD bond length | 0.031 |
| RMSD bond angle | 2.595 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.17) |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 47.240 | 47.240 | 1.620 |
| High resolution limit [Å] | 1.590 | 8.730 | 1.590 |
| Rmerge | 0.059 | 0.025 | 2.376 |
| Rmeas | 0.060 | 0.025 | 2.440 |
| Rpim | 0.014 | 0.006 | 0.547 |
| Total number of observations | 253117 | 1691 | 11735 |
| Number of reflections | 13052 | 105 | 616 |
| <I/σ(I)> | 24.3 | 106.5 | 1.4 |
| Completeness [%] | 99.9 | 99.7 | 97.4 |
| Redundancy | 19.4 | 16.1 | 19.1 |
| CC(1/2) | 1.000 | 1.000 | 0.769 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2M AmSu, 0.1M BIS-TRIS pH=5.5, 25% PEG 3350, 1.7 mM NiCl2 |
