5M6A
Crystal structure of cardiotoxic Bence-Jones light chain dimer H9
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 110 |
| Detector technology | PIXEL |
| Collection date | 2015-11-20 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 |
| Unit cell lengths | 46.492, 63.429, 86.637 |
| Unit cell angles | 95.32, 85.84, 99.58 |
Refinement procedure
| Resolution | 45.770 - 1.640 |
| R-factor | 0.184 |
| Rwork | 0.183 |
| R-free | 0.20300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1jvk |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.140 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.770 | 1.700 |
| High resolution limit [Å] | 1.640 | 1.640 |
| Rmerge | 0.087 | 0.540 |
| Number of reflections | 113757 | |
| <I/σ(I)> | 7.3 | 1.6 |
| Completeness [%] | 95.7 | 94.2 |
| Redundancy | 3.6 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | 0.1 M Sodium citrate, 16 % w/v PEG 4000, 10 % v/v 2-Propanol |
