3QTE
Crystal structure of human alpha-defensin 6 (H27W mutant)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2009-04-24 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 33.774, 32.675, 54.005 |
| Unit cell angles | 90.00, 108.35, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.949 |
| R-factor | 0.19487 |
| Rwork | 0.192 |
| R-free | 0.24665 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1zmq |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.816 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.980 |
| High resolution limit [Å] | 1.949 | 1.949 |
| Rmerge | 0.105 | 0.579 |
| Number of reflections | 8258 | |
| <I/σ(I)> | 16.5 | 2.5 |
| Completeness [%] | 99.0 | 92 |
| Redundancy | 5.7 | 4.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 294 | 0.1 M imidazole, pH 6.5, 1M Na acetate trihydrate, VAPOR DIFFUSION, HANGING DROP, temperature 294K |
