4Z3F
Crystal structure of the lectin domain of PapG from E. coli BI47 in complex with SSEA4 in space group P21
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-11-20 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.00004 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.110, 53.380, 48.820 |
| Unit cell angles | 90.00, 96.05, 90.00 |
Refinement procedure
| Resolution | 44.860 - 1.800 |
| R-factor | 0.2018 |
| Rwork | 0.201 |
| R-free | 0.22520 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1j8s |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.030 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.860 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.127 | 1.408 |
| Number of reflections | 21418 | |
| <I/σ(I)> | 10 | 1.3 |
| Completeness [%] | 99.6 | 97.1 |
| Redundancy | 4.9 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.15 M Zn acetate, 0.0 5M ZnCl2, 0.1MTris pH 7.5, 13% PEG6000 |
