5KBC
Crystal structure of Chlamydia trachomatis DsbA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-08-24 |
| Detector | RIGAKU SATURN 944 |
| Wavelength(s) | 1.541870 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 92.251, 98.131, 44.789 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.319 - 2.706 |
| R-factor | 0.2492 |
| Rwork | 0.248 |
| R-free | 0.28230 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3eu3 |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.692 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER (2.5.0) |
| Refinement software | PHENIX (1.8_1069) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.319 | 2.715 |
| High resolution limit [Å] | 2.706 | 2.706 |
| Rmerge | 0.101 | 0.401 |
| Number of reflections | 11646 | |
| <I/σ(I)> | 19.6 | 5.9 |
| Completeness [%] | 100.0 | 86.4 |
| Redundancy | 7.1 | 7.2 |
| CC(1/2) | 0.998 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 9 | 298 | 100 mM Bis Tris pH 9.0, 3.1 M sodium formate, 4 % (v/v) Tacsimate |
