1P73
Crystal structure of EHV4-TK complexed with TP4A
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 |
Wavelength(s) | 0.9 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 111.347, 118.293, 122.652 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 * - 2.700 |
R-factor | 0.21889 |
Rwork | 0.213 |
R-free | 0.27600 * |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1p72 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.420 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
High resolution limit [Å] | 2.700 | |
Rmerge | 0.097 * | 0.378 * |
Number of reflections | 45176 | |
Completeness [%] | 98.4 * | 91 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 * | 298 | Ammonium sulfate, MES, Dioxane, pH 6.5, Vapor Diffusion, Hanging drop, microseeding, temperature 298K, VAPOR DIFFUSION, HANGING DROP |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | reservoir | MES | 0.1 (M) | pH6.5 |
10 | 1 | drop | 100 (mM) | ||
11 | 1 | drop | glycerol | 5 (%) | |
2 | 1 | reservoir | ammonium sulfate | 1.2 (M) | |
3 | 1 | reservoir | dioxane | 5 (%) | |
4 | 1 | drop | enzyme | 5.5 (mg/ml) | |
5 | 1 | drop | TMP | 1.0 (mM) | |
6 | 1 | drop | ADP | 2.0 (mM) | |
7 | 1 | drop | HEPES | 25 (mM) | pH7.0 |
8 | 1 | drop | 5 (mM) | ||
9 | 1 | drop | dithiothreitol | 5 (mM) |