6SK3
C-terminal HsNMT1 deltaC3 truncation in complex with both MyrCoA and GNCFSKPR substrates
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-07-05 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.978565 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 91.806, 58.074, 148.212 |
| Unit cell angles | 90.00, 92.25, 90.00 |
Refinement procedure
| Resolution | 46.873 - 2.700 |
| R-factor | 0.2472 |
| Rwork | 0.246 |
| R-free | 0.26860 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.768 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.32) |
| Phasing software | PHASER (2.6.0) |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 49.070 | 49.070 | 2.830 |
| High resolution limit [Å] | 2.700 | 8.960 | 2.700 |
| Rmerge | 0.171 | 0.056 | 0.707 |
| Rmeas | 0.187 | 0.061 | 0.781 |
| Rpim | 0.074 | 0.024 | 0.322 |
| Total number of observations | 129478 | 4104 | 13525 |
| Number of reflections | 21519 | 630 | 2718 |
| <I/σ(I)> | 7.4 | 21.1 | 2 |
| Completeness [%] | 99.1 | 98.6 | 95.8 |
| Redundancy | 6 | 6.5 | 5 |
| CC(1/2) | 0.994 | 0.997 | 0.842 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | 19% PEG6K, 100mM Sodium Citrate pH 5.6, 100mM MgCl2, 100mM NaCl. |
