3LE0
Lectin Domain of Lectinolysin complexed with Glycerol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 14-BM-C |
| Synchrotron site | APS |
| Beamline | 14-BM-C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-03-27 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 67.189, 67.189, 98.322 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.460 - 1.910 |
| R-factor | 0.17612 |
| Rwork | 0.175 |
| R-free | 0.20570 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2j1r |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.466 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (1.3.2) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 29.460 | 50.000 | 1.970 |
| High resolution limit [Å] | 1.900 | 4.090 | 1.900 |
| Rmerge | 0.091 | 0.063 | 0.556 |
| Number of reflections | 16856 | ||
| <I/σ(I)> | 10.5 | ||
| Completeness [%] | 91.5 | 97.7 | 72.3 |
| Redundancy | 15.9 | 14.7 | 13.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 294 | 2M MgSO4, 100mM Tris, pH 8.5, vapor diffusion, hanging drop, temperature 294K |
