4C7I
Leismania major N-myristoyltransferase in complex with a peptidomimetic (-OH) 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 | 2012-05-28 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.641, 91.056, 53.596 |
| Unit cell angles | 90.00, 113.98, 90.00 |
Refinement procedure
| Resolution | 45.570 - 1.300 |
| R-factor | 0.16944 |
| Rwork | 0.168 |
| R-free | 0.19861 |
| Structure solution method | OTHER |
| RMSD bond length | 0.030 |
| RMSD bond angle | 2.745 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.000 | 1.320 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.040 | 0.370 |
| Number of reflections | 100469 | |
| <I/σ(I)> | 14.5 | 2.3 |
| Completeness [%] | 96.2 | 74 |
| Redundancy | 3.3 | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | 27% PEG1500, 0.2M NACL, 0.1M BIS-TRIS PH 5.5 |
