3TUS
Crystal Structure of C-lobe of Bovine lactoferrin Complexed with Meta-hydroxy benzoic acid at 2.5 A Resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 298 |
Detector technology | IMAGE PLATE |
Collection date | 2011-09-04 |
Detector | MARRESEARCH |
Wavelength(s) | 1.541 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.431, 50.492, 65.404 |
Unit cell angles | 90.00, 107.32, 90.00 |
Refinement procedure
Resolution | 39.260 - 2.500 |
R-factor | 0.218 |
Rwork | 0.218 |
R-free | 0.24100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ib0 |
RMSD bond length | 0.013 |
RMSD bond angle | 2.000 |
Data reduction software | AUTOMAR |
Phasing software | AMoRE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.260 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Number of reflections | 12573 | |
<I/σ(I)> | 8.4 | 2 |
Completeness [%] | 92.2 | 95.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | 0.01M Znso4, 0.1M MES, 25% PEG, Monomethyl Ether 550 , pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |