6P9J
crystal structure of human anti staphylococcus aureus antibody STAU-229 Fab
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-04-24 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 0.9787 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 57.827, 66.039, 112.329 |
| Unit cell angles | 90.00, 96.41, 90.00 |
Refinement procedure
| Resolution | 42.628 - 2.200 |
| R-factor | 0.2206 |
| Rwork | 0.218 |
| R-free | 0.26700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5jrp |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.722 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.15.2_3472: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.920 | 2.320 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.081 | 0.788 |
| Number of reflections | 43034 | 6144 |
| <I/σ(I)> | 10.9 | |
| Completeness [%] | 99.7 | |
| Redundancy | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291.15 | 0.1 M ammonium acetate, 0.1 M Bis-tris pH 5.5, 17% PEG 10,000 |
