5YK2
The complex structure of Rv3197-erythromycin from Mycobacterium tuberculosis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-10-09 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97855 |
| Spacegroup name | P 63 2 2 |
| Unit cell lengths | 187.238, 187.238, 67.205 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 34.712 - 2.807 |
| R-factor | 0.2317 |
| Rwork | 0.229 |
| R-free | 0.27380 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5yjz |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.721 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.8.4_1496) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.900 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.079 | 0.723 |
| Number of reflections | 17350 | 1686 |
| <I/σ(I)> | 26.5 | 2.7 |
| Completeness [%] | 99.4 | 100 |
| Redundancy | 13.2 | 13.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 1.8M ammonium sulfate, 0.1M Bis-Tris (pH 6.5), 2% (v/v) polyethylene glycol monomethyl ether 550 |
