1XB8
Zn substituted form of D62C/K74C double mutant of Pseudomonas Aeruginosa Azurin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | OXFORD DIFFRACTION ENHANCE ULTRA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-01-27 |
| Detector | OXFORD ONYX CCD |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 113.140, 50.038, 57.722 |
| Unit cell angles | 90.00, 119.51, 90.00 |
Refinement procedure
| Resolution | 50.250 - 2.000 |
| R-factor | 0.19428 |
| Rwork | 0.192 |
| R-free | 0.23562 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1azu |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.611 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.250 | 2.150 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.072 | 0.250 |
| Number of reflections | 18766 | |
| <I/σ(I)> | 17.2 | 3.06 |
| Completeness [%] | 99.8 | 99.4 |
| Redundancy | 4.04 | 4.03 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.2 M Ammonium Sulfate, 0.1 M Cacodylate, 30% PEG 8000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |
