Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "0f53092a3334c53e5d62abf5782dbb7d",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 35.996,
"b": 64.880,
"c": 73.377,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.11600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.60,1.65],
"number_observations": 121592,
"number_observations_unique": 20222,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 16.7
},
{
"type": "Completeness",
"value": 95.0
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.68,1.65],
"number_observations": 2539,
"number_observations_unique": 657,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.482
},
{
"type": "R(meas)",
"value": 1.703
},
{
"type": "R(pim)",
"value": 0.817
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.344
}
]
}
]
}