3FN7
Crystal structure of sortase A (Spy1154) from Streptococcus pyogenes serotype M1 strain SF370
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2007-07-01 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 66.030, 69.890, 40.150 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.850 - 1.750 |
| R-factor | 0.19846 |
| Rwork | 0.196 |
| R-free | 0.23891 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3fn6 |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.548 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.4.0067) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.850 | 1.790 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Number of reflections | 21140 | |
| <I/σ(I)> | 27.6 | 5.6 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 13.4 | 12.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 100 mM Tris (pH 6 - 7), 20 30 % (w/v) polyethyleneglycol (PEG) 8000 and 200 mM sodium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
