1A3Z
REDUCED RUSTICYANIN AT 1.9 ANGSTROMS
Experimental procedure
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH2R |
| Temperature [K] | 293 |
| Detector technology | AREA DETECTOR |
| Collection date | 1995-06 |
| Detector | ADSC |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 32.450, 60.590, 38.080 |
| Unit cell angles | 90.00, 108.02, 90.00 |
Refinement procedure
| Resolution | 100.000 - 1.900 |
| R-factor | 0.213 |
| Rwork | 0.213 |
| R-free | 0.27200 |
| Structure solution method | PHASES TAKEN FROM THE OXIDIZED FORM, PDB ENTRY 1RCY |
| Starting model (for MR) | 1rcy |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.400 |
| Phasing software | X-PLOR (3.8) |
| Refinement software | X-PLOR (3.8) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.000 | 1.969 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.063 | 0.199 |
| Number of reflections | 9718 | |
| <I/σ(I)> | 13.3 | 3.02 |
| Completeness [%] | 87.4 | 78 |
| Redundancy | 1.97 | 1.42 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | VAPOR DIFFUSION IN HANGING DROPS AGAINST 100 MM-SODIUM CITRATE, PH 4.6, 200 MM LITHIUM CHLORIDE AND 25%(W/V) PEG 8000 AT 277K. CRYSTALS SOAKED IN 10MM DITHIONITE FOR 3 DAYS PRIOR TO DATA COLLECTION., vapor diffusion - hanging drop |
