1XB3
The D62C/K74C double mutant of Pseudomonas Aeruginosa Azurin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX II BEAMLINE I711 |
| Synchrotron site | MAX II |
| Beamline | I711 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-06-10 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.996 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 81.412, 87.338, 31.366 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 59.760 - 1.501 |
| R-factor | 0.17185 |
| Rwork | 0.170 |
| R-free | 0.21423 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4azu |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.483 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.760 | 1.550 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.043 | 0.173 |
| Number of reflections | 35091 | |
| <I/σ(I)> | 24.53 | 10.1 |
| Completeness [%] | 95.5 | 90.5 |
| Redundancy | 7 | 7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 293 | 20-23% PEG 3350, 0.25M MgCl2, 0.1M Sodium Acetate, pH 4.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
