5C9P
Crystal structure of recombinant PLL lectin complexed with L-fucose from Photorhabdus luminescens at 1.75 A resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-12-06 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.918 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 72.783, 87.717, 158.194 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.100 - 1.750 |
| R-factor | 0.14363 |
| Rwork | 0.142 |
| R-free | 0.18111 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5c9o |
| RMSD bond length | 0.024 |
| RMSD bond angle | 2.124 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.710 | 1.840 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.090 | 0.462 |
| Number of reflections | 51368 | |
| <I/σ(I)> | 14.1 | 3.4 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 6.7 | 6.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 290.15 | 0.1 M Tris-HCl, 2.5 % ethanol, pH 8.5 |
