2NLC
Human beta-defensin-1 (mutant Ser8Ala)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-08-10 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54178 |
Spacegroup name | P 1 |
Unit cell lengths | 25.740, 33.190, 41.850 |
Unit cell angles | 73.90, 85.50, 86.20 |
Refinement procedure
Resolution | 30.000 - 1.650 |
R-factor | 0.168 |
Rwork | 0.166 |
R-free | 0.20400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ijv |
RMSD bond length | 0.019 |
RMSD bond angle | 1.666 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.710 |
High resolution limit [Å] | 1.650 | 1.650 |
Rmerge | 0.051 | 0.207 |
Number of reflections | 14783 | |
<I/σ(I)> | 29 | 6.4 |
Completeness [%] | 92.6 | 85.8 |
Redundancy | 6.4 | 5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7 | 293 | PEG 8000, LITHIUM SULFATE, pH 7.0, vapor diffusion, temperature 293K |