6H4L
Structure of Titin M4 trigonal form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-07-02 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.286 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 84.847, 84.847, 49.177 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 27.773 - 1.600 |
| R-factor | 0.2089 |
| Rwork | 0.208 |
| R-free | 0.22120 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.081 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.400 | 1.690 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.051 | 0.458 |
| Rmeas | 0.053 | |
| Rpim | 0.015 | 0.203 |
| Number of reflections | 27114 | 3942 |
| <I/σ(I)> | 24.8 | |
| Completeness [%] | 99.6 | 99.9 |
| Redundancy | 11.3 | 5.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | MES pH 6.5 2M RbBr |
