3MIT
Structure of Banana lectin-alpha-D-mannose complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-07-25 |
Detector | MARRESEARCH |
Wavelength(s) | 1.54 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 80.926, 80.926, 148.173 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 25.460 - 2.320 |
R-factor | 0.20541 |
Rwork | 0.203 |
R-free | 0.24628 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1x1v |
RMSD bond length | 0.009 |
RMSD bond angle | 1.192 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.400 |
High resolution limit [Å] | 2.320 | 2.320 |
Rmerge | 0.077 | 0.489 |
Number of reflections | 24663 | |
<I/σ(I)> | 16.4 | 3.3 |
Completeness [%] | 98.4 | 98.4 |
Redundancy | 4.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 298 | ZINC ACETATE DIHYDRATE, SODIUM CACODYLATE, 1,6-HEXANEDIOL, , pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K |