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 |