2DEX
Crystal structure of human peptidylarginine deiminase 4 in complex with histone H3 N-terminal peptide including Arg17
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-03-01 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0000 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 146.072, 60.103, 115.703 |
Unit cell angles | 90.00, 124.32, 90.00 |
Refinement procedure
Resolution | 33.130 - 2.100 |
R-factor | 0.20698 |
Rwork | 0.203 |
R-free | 0.24698 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1wda |
RMSD bond length | 0.012 |
RMSD bond angle | 1.467 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.130 | 2.170 |
High resolution limit [Å] | 2.100 | 2.100 |
Number of reflections | 46064 | |
Completeness [%] | 94.6 | 94.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 0.1M Imidazole (pH8.0), 0.2M lithium sulfate, 10% PEGMME2000, VAPOR DIFFUSION, HANGING DROP, temperature 293K |