3ILQ
Structure of mCD1d with bound glycolipid BbGL-2c from Borrelia burgdorferi
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL7-1 |
| Synchrotron site | SSRL |
| Beamline | BL7-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-04-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 41.706, 97.791, 55.421 |
| Unit cell angles | 90.00, 106.94, 90.00 |
Refinement procedure
| Resolution | 35.070 - 2.050 |
| R-factor | 0.20952 |
| Rwork | 0.208 |
| R-free | 0.25102 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2akr |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.479 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.120 |
| High resolution limit [Å] | 2.050 | 2.050 |
| Rmerge | 0.042 | 0.604 |
| Number of reflections | 25018 | |
| <I/σ(I)> | 35.9 | 3.6 |
| Completeness [%] | 93.9 | 90 |
| Redundancy | 4.4 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5 | 295 | 17% polyethylene glycol 3350, 150mM di-ammonium hydrogen citrate, pH 5.0, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
