1NAT
CRYSTAL STRUCTURE OF SPOOF FROM BACILLUS SUBTILIS
Experimental procedure
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH2R |
| Temperature [K] | 300 |
| Detector technology | AREA DETECTOR |
| Collection date | 1991-09 |
| Detector | XUONG-HAMLIN MULTIWIRE |
| Spacegroup name | P 42 21 2 |
| Unit cell lengths | 58.500, 58.500, 85.400 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 8.000 - 2.450 |
| R-factor | 0.176 * |
| Rwork | 0.181 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 13 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.800 |
| Data reduction software | UCSD |
| Data scaling software | SCAL1 ((UCSD)) |
| Phasing software | X-PLOR |
| Refinement software | X-PLOR |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.640 |
| High resolution limit [Å] | 2.450 | 2.450 |
| Rmerge | 0.057 | 0.153 |
| Total number of observations | 24763 * | |
| Number of reflections | 5449 * | |
| <I/σ(I)> | 19.8 | 4.2 |
| Completeness [%] | 92.7 | 79.8 |
| Redundancy | 4.5 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 7.8 | 4 * | pH 7.8 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 15 (mg/ml) | |
| 2 | 1 | reservoir | PEG4500 | 25 (%) | |
| 3 | 1 | reservoir | ethanol | 15 (%) | |
| 4 | 1 | reservoir | sodium potassium phosphate | 100 (mM) | pH7.8 |
