1S0Z
Crystal structure of the VDR LBD complexed to seocalcitol.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM30A |
Synchrotron site | ESRF |
Beamline | BM30A |
Temperature [K] | 288 |
Detector technology | CCD |
Collection date | 1999-04-15 |
Detector | MARRESEARCH |
Wavelength(s) | 1.00094 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 45.134, 52.528, 132.648 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 15.000 - 2.500 |
R-factor | 0.204 |
Rwork | 0.170 |
R-free | 0.20400 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.068 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.000 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Number of reflections | 11284 | |
Completeness [%] | 98.3 | 98 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | Ammonium sulfate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |