4IVV
Catalytic amidase domain of the major autolysin LytA from Streptococcus pneumaniae
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-10-23 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.97900 |
| Spacegroup name | P 32 |
| Unit cell lengths | 50.440, 50.440, 72.610 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 17.460 - 1.050 |
| R-factor | 0.1421 |
| Rwork | 0.141 |
| R-free | 0.15703 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.190 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SHELXS |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.700 | 1.110 |
| High resolution limit [Å] | 1.050 | 1.050 |
| Rmerge | 0.068 | 0.530 |
| Number of reflections | 95581 | |
| <I/σ(I)> | 7.3 | 1.7 |
| Completeness [%] | 99.0 | 100 |
| Redundancy | 2.7 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.7 | 293 | PEG 6000 12%, 0.1M TrisHCl, LiCl 0.8M, pH 6.7, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
