3F64
F17a-G lectin domain with bound GlcNAc(beta1-O)paranitrophenyl ligand
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE BW7A |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | BW7A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-10-01 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.9183 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 43.025, 43.025, 288.450 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.060 - 1.950 |
| R-factor | 0.20587 |
| Rwork | 0.204 |
| R-free | 0.24845 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1o9v |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.301 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.020 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.075 | 0.297 |
| Number of reflections | 12042 | |
| <I/σ(I)> | 22.2 | 10.2 |
| Completeness [%] | 94.4 | 91.6 |
| Redundancy | 14.7 | 9.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 10% 2-propanol, 20% PEG 4000, 100mM HEPES, pH7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
