Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4ad83a448d73e73115595d3d9c9b26df",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 91.613,
"b": 91.613,
"c": 229.822,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,2.79],
"number_observations_unique": 14939,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(meas)",
"value": 0.148
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 18.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 8.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.85,2.80],
"number_observations_unique": 728,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.565
},
{
"type": "R(meas)",
"value": 1.66
},
{
"type": "R(pim)",
"value": 0.548
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 9.0
},
{
"type": "CC(1/2)",
"value": 0.675
}
]
}
]
}