2VFC
The structure of Mycobacterium marinum arylamine N-acetyltransferase in complex with CoA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 48.950, 98.000, 123.900 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.230 - 2.700 |
| R-factor | 0.185 |
| Rwork | 0.181 |
| R-free | 0.25400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2vfb |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.936 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.880 | 2.850 |
| High resolution limit [Å] | 2.600 | 2.700 |
| Rmerge | 0.160 | 0.400 |
| Number of reflections | 16557 | |
| <I/σ(I)> | 4.27 | 1.8 |
| Completeness [%] | 97.3 | 88.1 |
| Redundancy | 5.27 | 3.39 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.6 | 0.1M NA CITRATE PH5.6, 10% W/V 2-PROPANOL AND 22% PEG 4,000 |
