Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "22863b33925c23977498429fff377c68",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 84.755,
"b": 67.082,
"c": 89.580,
"alpha": 90.00,
"beta": 117.03,
"gamma": 90.00
},
"wavelengths": [0.68880],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [75.494,0.998],
"number_observations_unique": 380275,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 13.8
},
{
"type": "CC(1/2)",
"value": 1
}
]
},
"refln_shells": [
{
"resolution_limits": [75.494,2.956],
"number_observations_unique": 19014,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.01
},
{
"type": "I/SigI",
"value": 25.6
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 14.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.069,0.998],
"number_observations_unique": 19014,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.084
},
{
"type": "R(meas)",
"value": 2.179
},
{
"type": "R(pim)",
"value": 0.625
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 82.9
},
{
"type": "Redundancy",
"value": 11.5
},
{
"type": "CC(1/2)",
"value": 0.529
}
]
}
]
}