1FT4
PHOTOCHEMICALLY-ENHANCED BINDING OF SMALL MOLECULES TO THE TUMOR NECROSIS FACTOR RECEPTOR-1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 5ID-B |
Synchrotron site | APS |
Beamline | 5ID-B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2000-02-13 |
Detector | MARRESEARCH |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 67.800, 67.800, 190.000 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 10.000 - 2.900 |
R-factor | 0.274 * |
Rwork | 0.274 |
RMSD bond length | 0.013 |
RMSD bond angle | 3.100 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | EPMR |
Refinement software | X-PLOR (3.851) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 35.000 |
High resolution limit [Å] | 2.900 |
Rmerge | 0.093 |
Number of reflections | 9191 |
<I/σ(I)> | 17 |
Completeness [%] | 88.0 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 * | Rodseth, L.E., (1994) J.Mol.Biol., 239, 332. * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 1.6 (mg/ml) | |
2 | 1 | drop | MPD | 25 (%(v/v)) | |
3 | 1 | drop | Tris-HCl | 50 (mM) | |
4 | 1 | drop | beta-octylglucoside | 0.1 (%(w/v)) | |
5 | 1 | drop | 100 (mM) | ||
6 | 1 | drop | ammonium acetate | 250 (mM) | |
7 | 1 | reservoir | MPD | 54 (%) | |
8 | 1 | reservoir | Tris-HCl | 100 (mM) | |
9 | 1 | reservoir | ammonium acetate | 500 (mM) |