2NLD
Human beta-defensin-1 (Mutant Gln11Ala)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-07-21 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54178 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 32.840, 23.570, 40.450 |
Unit cell angles | 90.00, 107.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.490 |
R-factor | 0.138 |
Rwork | 0.134 |
R-free | 0.19900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ijv |
RMSD bond length | 0.017 |
RMSD bond angle | 1.569 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.540 |
High resolution limit [Å] | 1.490 | 1.490 |
Rmerge | 0.055 | 0.266 |
Number of reflections | 9213 | |
<I/σ(I)> | 26 | 4.5 |
Completeness [%] | 92.8 | 77.2 |
Redundancy | 5.1 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 4.6 | 293 | PEG 4000, AMMONIUM SULFATE, SODIUM ACETATE, GLYCEROL, pH 4.6, vapor diffusion, temperature 293K |