2NLP
Human beta-defensin-1 (Mutant Gln24Glu)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2005-12-03 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.54178 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 97.680, 27.680, 58.230 |
| Unit cell angles | 90.00, 113.60, 90.00 |
Refinement procedure
| Resolution | 30.000 - 1.850 |
| R-factor | 0.179 |
| Rwork | 0.176 |
| R-free | 0.23700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ijv |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.698 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.920 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.058 | 0.304 |
| Number of reflections | 12081 | |
| <I/σ(I)> | 27 | 6.1 |
| Completeness [%] | 96.4 | 94 |
| Redundancy | 6.2 | 6.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 293 | LITHIUM SULFATE, HEPES, pH 7.5, vapor diffusion, temperature 293K |
