2RA6
Crystal Structure of the Possum Milk Whey Lipocalin Trichosurin at pH 4.6 with Bound 4-ethylphenol
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 113 |
Detector technology | CCD |
Collection date | 2003-09-01 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.89 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.318, 100.470, 84.702 |
Unit cell angles | 90.00, 90.02, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.500 |
Rwork | 0.226 |
R-free | 0.24100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2r74 |
RMSD bond length | 0.005 |
RMSD bond angle | 1.179 |
Data scaling software | XSCALE |
Phasing software | AMoRE |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.600 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.072 | 0.289 |
Number of reflections | 117706 | |
<I/σ(I)> | 11.6 | 4.3 |
Completeness [%] | 99.5 | 96 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 291 | 100mM Sodium Acetate, 200mM ZnCl2, 8% 2-propanol, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 291K |