1TXT
Staphylococcus aureus 3-hydroxy-3-methylglutaryl-CoA synthase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2001-05-29 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 119.947, 64.482, 121.910 |
| Unit cell angles | 90.00, 97.17, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.501 |
| R-factor | 0.19068 |
| Rwork | 0.187 |
| R-free | 0.25493 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.935 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2.0003) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 99.000 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Number of reflections | 59484 | |
| <I/σ(I)> | 9.5 | 2.6 |
| Completeness [%] | 92.2 | 52.4 |
| Redundancy | 3.2 | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | ammonium sulfate, TRIS, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
