3GAQ
Female-specific Histamine-Binding Protein, D24R Mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RUH3R |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2008-12-08 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 57.963, 56.610, 63.801 |
Unit cell angles | 90.00, 107.08, 90.00 |
Refinement procedure
Resolution | 11.960 - 2.250 |
R-factor | 0.232 |
Rwork | 0.229 |
R-free | 0.28600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1qft |
RMSD bond length | 0.012 |
RMSD bond angle | 1.279 |
Data reduction software | MOSFLM |
Data scaling software | d*TREK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.5.0035) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 12.000 | 2.370 |
High resolution limit [Å] | 2.250 | 2.250 |
Rmerge | 0.090 | 0.300 |
Number of reflections | 18800 | |
<I/σ(I)> | 15.7 | 4.1 |
Completeness [%] | 99.3 | 100 |
Redundancy | 4 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 290 | Protein at 10 mg/ml mixed in a 1:1 ratio with reservoir containing: 2.6 M Ammonium Sulphate, 0.1 M Bicine, pH 8.2, and 10 % isopropanol, VAPOR DIFFUSION, HANGING DROP, temperature 290K |