6GNU
Crystal Structure of Leishmania major N-Myristoyltransferase (NMT) With Bound Myristoyl-CoA and a Quionlinyl aryl sulphonamide ligand
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-03-15 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.93 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.309, 89.934, 52.884 |
| Unit cell angles | 90.00, 114.74, 90.00 |
Refinement procedure
| Resolution | 44.970 - 1.540 |
| R-factor | 0.1582 |
| Rwork | 0.157 |
| R-free | 0.18540 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3h5z |
| RMSD bond length | 0.025 |
| RMSD bond angle | 2.403 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.000 | 1.590 |
| High resolution limit [Å] | 1.540 | 1.540 |
| Rmerge | 0.039 | 0.364 |
| Number of reflections | 59093 | |
| <I/σ(I)> | 21 | 2.9 |
| Completeness [%] | 97.5 | 85.8 |
| Redundancy | 3.4 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 291 | 26%PEG1500,0.2M NACL, 0.1M NACACODYLATE, PH 5.6 |
