4C7M
The crystal structure of TcpB or BtpA TIR domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.966, 73.676, 74.759 |
| Unit cell angles | 90.00, 93.29, 90.00 |
Refinement procedure
| Resolution | 42.420 - 2.570 |
| R-factor | 0.2322 |
| Rwork | 0.232 |
| R-free | 0.24010 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3h16 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.050 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.420 | 42.420 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.089 | 0.790 |
| Number of reflections | 18090 | |
| <I/σ(I)> | 1.9 | 1.9 |
| Completeness [%] | 99.7 | 99.7 |
| Redundancy | 3.7 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 0.1 M BIS-TRIS PH 5.5, 0.2 M NACL, 25%(W/V) PEG 3350 |
