3JTK
Crystal Structure of human type-I N-myristoyltransferase with bound myristoyl-CoA and inhibitor DDD90055
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-08-05 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 58.247, 79.023, 178.381 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.760 - 1.610 |
| R-factor | 0.19877 |
| Rwork | 0.198 |
| R-free | 0.22138 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3iu1 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.171 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.710 |
| High resolution limit [Å] | 1.610 | 1.610 |
| Rmerge | 0.067 | 0.444 |
| Number of reflections | 106602 | |
| <I/σ(I)> | 16.68 | 2.52 |
| Completeness [%] | 98.3 | 90.8 |
| Redundancy | 6.54 | 3.71 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.7 | 293 | 19% PEG3350, 0.2M di-ammonium hydrogen citrate, pH 5.7, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
