5A5A
The structure of GH101 E796Q mutant from Streptococcus pneumoniae TIGR4 in complex with PNP-T-antigen
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Temperature [K] | 100 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 86.861, 121.618, 139.403 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 91.640 - 1.750 |
| R-factor | 0.14864 |
| Rwork | 0.147 |
| R-free | 0.17401 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.449 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.840 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.070 | 0.400 |
| Number of reflections | 140912 | |
| <I/σ(I)> | 24.8 | 4.4 |
| Completeness [%] | 99.5 | 96.6 |
| Redundancy | 8.5 | 5.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
