3OU7
DhpI-SAM-HEP complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Detector | MAR scanner 300 mm plate |
Wavelength(s) | 0.97961 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 167.286, 167.286, 168.403 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 41.890 - 2.300 |
R-factor | 0.18097 |
Rwork | 0.179 |
R-free | 0.22708 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ou6 |
RMSD bond length | 0.023 |
RMSD bond angle | 1.990 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0066) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.136 | 0.529 |
Number of reflections | 58659 | |
<I/σ(I)> | 19.9 | 3.6 |
Completeness [%] | 94.6 | 96.3 |
Redundancy | 10.2 | 7.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 273 | 1.6 M Ammonium sulphate, 100 mM Tris-HCl pH=8.0, VAPOR DIFFUSION, HANGING DROP, temperature 273K |