3IIF
Crystal structure of the macro domain of human histone macroH2A1.1 in complex with ADP-ribose (form B)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-06-17 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.976 |
| Spacegroup name | H 3 |
| Unit cell lengths | 129.610, 129.610, 128.290 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 64.820 - 2.100 |
| R-factor | 0.1813 |
| Rwork | 0.180 |
| R-free | 0.20459 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3iid |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.662 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 64.820 | 2.160 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Number of reflections | 46730 | |
| <I/σ(I)> | 14 | 3.2 |
| Completeness [%] | 99.7 | 96.2 |
| Redundancy | 5.1 | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 294 | 0.8 M (NH4)2SO4, 0.2 M Sodium acetate, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 294K |
