2J1V
Structure of a Streptococcus pneumoniae fucose binding module in complex with the blood group H-trisaccharide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Temperature [K] | 113 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 43.827, 60.465, 99.498 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 51.990 - 1.450 |
| R-factor | 0.154 |
| Rwork | 0.152 |
| R-free | 0.20800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.629 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.500 |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.065 | 0.384 |
| Number of reflections | 45077 | |
| <I/σ(I)> | 13.8 | 4.2 |
| Completeness [%] | 99.6 | 99.5 |
| Redundancy | 6.4 | 6.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 20-22% polyethylene glycol 1500, 0.15M KSCN, and 0.1M Tris-HCl, pH 7.5 |
