3RPM
Crystal structure of the first GH20 domain of a novel Beta-N-acetyl-hexosaminidase StrH from Streptococcus pneumoniae R6
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-12-30 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97893 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 173.984, 173.984, 108.204 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.560 - 2.100 |
R-factor | 0.19312 |
Rwork | 0.192 |
R-free | 0.22133 |
Structure solution method | SAD |
RMSD bond length | 0.012 |
RMSD bond angle | 1.192 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.140 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.109 | 0.475 |
Number of reflections | 209284 | |
<I/σ(I)> | 21.3 | 3.7 |
Completeness [%] | 98.2 | 86.7 |
Redundancy | 10.9 | 8.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 289 | 30% PEG 4000, 0.2M ammonium acetate, 0.1M Sodium citrate tribasic dehydrate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 289K |