3SGE
Crystal structure of mAb 17.2 in complex with R13 peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM30A |
| Synchrotron site | ESRF |
| Beamline | BM30A |
| Temperature [K] | 122 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 83.000, 68.210, 92.120 |
| Unit cell angles | 90.00, 98.37, 90.00 |
Refinement procedure
| Resolution | 29.690 - 1.890 |
| R-factor | 0.1811 |
| Rwork | 0.179 |
| R-free | 0.21070 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3sgd |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.150 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | BUSTER (2.9.3) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 30.000 |
| High resolution limit [Å] | 1.890 |
| Rmerge | 0.049 |
| Number of reflections | 73894 |
| <I/σ(I)> | 22.9 |
| Completeness [%] | 94.6 |
| Redundancy | 3.47 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.7 | 291 | 18% (w/v) PEG 8000, 0.1M sodium cacodylate pH 6.7, 0.2M calcium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
