6PRX
oxidized Human Branched Chain Aminotransferase mutant C318A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-04-01 |
| Detector | DECTRIS PILATUS3 R CdTe 300K |
| Wavelength(s) | 1.54180 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 69.204, 104.938, 106.294 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.460 - 3.250 |
| R-factor | 0.2218 |
| Rwork | 0.220 |
| R-free | 0.25940 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2hgw |
| RMSD bond length | 0.002 |
| RMSD bond angle | 1.142 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0253) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.280 |
| High resolution limit [Å] | 3.220 | 3.220 |
| Rpim | 0.040 | 0.214 |
| Number of reflections | 12545 | 586 |
| <I/σ(I)> | 11.85 | |
| Completeness [%] | 99.1 | 92.9 |
| Redundancy | 8.8 | |
| CC(1/2) | 0.871 | 0.871 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 293 | 200 mM magnesium acetate tetrahydrate, 100 mM sodium cacodylate trihydrate pH6.5, 20% w/v polyethylene glycol 8,000 |
