6YZG
Streptococcal surface adhesin - CshB NR2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-09-10 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 100.393, 100.393, 63.302 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 70.990 - 1.400 |
| R-factor | 0.183 |
| Rwork | 0.183 |
| R-free | 0.19500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5l2d |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.960 |
| Data reduction software | xia2 |
| Data scaling software | DIALS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.990 | 1.400 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.050 | 0.552 |
| Rmeas | 0.057 | 0.686 |
| Number of reflections | 64024 | 3123 |
| <I/σ(I)> | 15.24 | |
| Completeness [%] | 100.0 | 99.1 |
| Redundancy | 6.7 | 4.9 |
| CC(1/2) | 0.998 | 0.796 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.1 M SPG buffer pH 5, 25% w/v PEG 1500 |
