Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dc876cfc7bcd6776e792e49d8a8fb4ed",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.995,
"b": 53.094,
"c": 44.493,
"alpha": 90.00,
"beta": 103.05,
"gamma": 90.00
},
"wavelengths": [0.91266],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.11,1.74],
"number_observations": 83035,
"number_observations_unique": 26176,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.137
},
{
"type": "R(pim)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 13.6
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.74],
"number_observations": 4606,
"number_observations_unique": 1402,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.304
},
{
"type": "R(meas)",
"value": 2.735
},
{
"type": "R(pim)",
"value": 1.454
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.024
}
]
}
]
}