4Z3G
Crystal structure of the lectin domain of PapG from E. coli BI47 in complex with 4-methoxyphenyl beta-D-galabiose in space group P212121
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-08-15 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97618 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 56.270, 72.610, 94.860 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 57.660 - 1.450 |
| R-factor | 0.1698 |
| Rwork | 0.169 |
| R-free | 0.18870 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1j8s |
| RMSD bond length | 0.008 |
| 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] | 57.660 | 1.500 |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.058 | 0.910 |
| Number of reflections | 69025 | |
| <I/σ(I)> | 21.2 | 1.3 |
| Completeness [%] | 99.2 | 92.6 |
| Redundancy | 11.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 297 | 10 % PEG 10000 |
