5A67
Crystal structure of AtTTM3 in complex with tripolyphosphate and manganese ion (form B)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-05-02 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1.000020, 1.823310 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 44.375, 33.868, 72.216 |
| Unit cell angles | 90.00, 94.97, 90.00 |
Refinement procedure
| Resolution | 19.610 - 1.300 |
| R-factor | 0.14211 |
| Rwork | 0.140 |
| R-free | 0.17542 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5a5y |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.695 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0123) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.600 | 1.370 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.050 | 0.770 |
| Number of reflections | 52725 | |
| <I/σ(I)> | 20.04 | 1.94 |
| Completeness [%] | 98.3 | 93.3 |
| Redundancy | 6.24 | 5.27 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 20 % PEG 3350,0.2M NACL, 0.1 M BISTRIS PH 7.0 |
