2YDL
Crystal structure of SH3C from CIN85
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER FR530 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2007-09-04 |
| Detector | MARRESEARCH |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 47.828, 47.828, 70.235 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 41.420 - 2.050 |
| R-factor | 0.2074 |
| Rwork | 0.205 |
| R-free | 0.25222 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1sem |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.419 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 26.780 | 2.140 |
| High resolution limit [Å] | 2.030 | 2.030 |
| Rmerge | 0.280 | 0.230 |
| Number of reflections | 5991 | |
| <I/σ(I)> | 8.31 | 3.2 |
| Completeness [%] | 95.4 | 82.3 |
| Redundancy | 3.13 | 3.13 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.1M CITRATE PH 5.5, 2.0 M AMMONIUM SULPHATE |
