Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "416d7814ca6f913d951b7ffedf7e72b4",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 65.978,
"b": 100.883,
"c": 195.522,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.9,2.52],
"number_observations_unique": 36937,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.109
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 10.5
},
{
"type": "Completeness",
"value": 92.8
},
{
"type": "Redundancy",
"value": 4.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.56,2.52],
"number_observations_unique": 103,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.056
},
{
"type": "R(meas)",
"value": 1.243
},
{
"type": "R(pim)",
"value": 0.646
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 4.3
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.530
}
]
}
]
}