1KXP
CRYSTAL STRUCTURE OF HUMAN VITAMIN D-BINDING PROTEIN IN COMPLEX WITH SKELETAL ACTIN
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 14-BM-C |
Synchrotron site | APS |
Beamline | 14-BM-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2001-12-09 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 80.758, 87.364, 162.686 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.000 - 2.100 |
Rwork | 0.217 |
R-free | 0.23600 |
RMSD bond length | 0.005 |
RMSD bond angle | 20.640 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.180 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.093 | 0.286 |
Total number of observations | 1064049 * | |
Number of reflections | 67458 | |
<I/σ(I)> | 23.4 | 11.2 |
Completeness [%] | 99.8 | 98.8 |
Redundancy | 15.8 | 11.0 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.6 * | 4 * | Peg 8K 12%, Magnesium Acetate 200mM, Sodium Cacodylate 100 mM, Glycerol 20%, pH 6.6, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | Tris | 100 (mM) | pH7.6 |
2 | 1 | drop | ATP | 0.6 (mM) | |
3 | 1 | drop | beta-mercaptoethanol | 0.5 (mM) | |
4 | 1 | drop | 0.2 (mM) | ||
5 | 1 | drop | protein | 20 (mg/ml) | |
6 | 1 | reservoir | PEG12000 | 11 (%) | |
7 | 1 | reservoir | magnesium acetate | 200 (mM) | |
8 | 1 | reservoir | sodium cacodylate | 100 (mM) | pH6.6 |
9 | 1 | reservoir | glycerol | 20 (%) |