4QFB
1.99 A resolution structure of SeMet-CT263 (MTAN) from Chlamydia trachomatis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-02-07 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97911 |
| Spacegroup name | P 21 2 21 |
| Unit cell lengths | 60.853, 74.234, 78.060 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.030 - 1.986 |
| R-factor | 0.17 |
| Rwork | 0.167 |
| R-free | 0.21160 |
| Structure solution method | SAD |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.109 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.990 | 2.030 |
| High resolution limit [Å] | 1.986 | 1.990 |
| Rmerge | 0.075 | 0.381 |
| Number of reflections | 24951 | |
| <I/σ(I)> | 14.5 | 4.1 |
| Completeness [%] | 99.4 | 95.3 |
| Redundancy | 6.2 | 6.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.4 | 298 | 50 mM Ammonium Sulfate, 100 mM BIS-TRIS (pH 6.4) and 32% (w/v) PEG 2K MME, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
