1PDQ
Polycomb chromodomain complexed with the histone H3 tail containing trimethyllysine 27.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-04-20 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.97934 |
Spacegroup name | I 21 21 21 |
Unit cell lengths | 32.120, 75.810, 80.460 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 * - 1.760 |
R-factor | 0.223 |
Rwork | 0.223 |
R-free | 0.25230 * |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB 1KNA |
RMSD bond length | 0.006 |
RMSD bond angle | 1.170 * |
Data reduction software | HKL-2000 |
Data scaling software | CCP4 ((TRUNCATE)) |
Phasing software | MOLREP |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.820 |
High resolution limit [Å] | 1.760 | 1.760 |
Rmerge | 0.033 * | 0.212 * |
Number of reflections | 9494 | |
<I/σ(I)> | 32.6 | 2.95 |
Completeness [%] | 93.7 | 74.2 |
Redundancy | 4.1 | 1.7 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 * | 10 or 4 * | 0.1 M Tris-HCl, 0.2 M Lithium sulfate, 30 % PEG 4000, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | Tris-HCl | 20 (mM) | pH8.0 |
2 | 1 | drop | 50 (mM) | ||
3 | 1 | drop | protein | 5 (mg/ml) | |
4 | 1 | reservoir | Tris-HCl | 0.1 (M) | pH8.5 |
5 | 1 | reservoir | 0.2 (M) | ||
6 | 1 | reservoir | PEG4000 | 30 (%) |