4C7H
Leismania major N-myristoyltransferase in complex with a peptidomimetic (-NH2) molecule
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-03-08 |
| Detector | DECTRIS PILATUS |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.659, 91.131, 53.777 |
| Unit cell angles | 90.00, 113.85, 90.00 |
Refinement procedure
| Resolution | 22.260 - 1.400 |
| R-factor | 0.17419 |
| Rwork | 0.173 |
| R-free | 0.20492 |
| Structure solution method | OTHER |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.029 |
| RMSD bond angle | 2.737 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.000 | 1.430 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.060 | 0.640 |
| Number of reflections | 83119 | |
| <I/σ(I)> | 10.2 | 1.9 |
| Completeness [%] | 98.7 | 98.9 |
| Redundancy | 4.2 | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | 28% PEG1450, 0.2M NACL, 0.1M BIS-TRIS PH 5.5 |
