5M76
Crystal structure of cardiotoxic Bence-Jones light chain dimer H10
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-04-30 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97625 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 55.493, 71.417, 103.929 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.950 - 2.500 |
| R-factor | 0.241 |
| Rwork | 0.239 |
| R-free | 0.28240 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5m6a |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.595 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.950 | 2.640 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.108 | 0.510 |
| Number of reflections | 14761 | |
| <I/σ(I)> | 8.6 | 2.3 |
| Completeness [%] | 99.2 | 97.9 |
| Redundancy | 4.3 | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.05M KBr, 30% PEG 2000 |
