Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "69710a75232fbdc5c5d733b7b831c5e2",
"space_group_name": "P 1",
"unit_cell": {
"a": 52.161,
"b": 53.794,
"c": 103.003,
"alpha": 104.800,
"beta": 101.825,
"gamma": 92.570
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.85,2.03],
"number_observations_unique": 67042,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1322
},
{
"type": "I/SigI",
"value": 11.11
},
{
"type": "Completeness",
"value": 98.03
},
{
"type": "Redundancy",
"value": 3.63
},
{
"type": "CC(1/2)",
"value": 0.9918
}
]
},
"refln_shells": [
{
"resolution_limits": [2.06,2.03],
"number_observations_unique": 6591,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.2855
},
{
"type": "I/SigI",
"value": 1.07
},
{
"type": "Completeness",
"value": 95.11
},
{
"type": "Redundancy",
"value": 3.71
},
{
"type": "CC(1/2)",
"value": 0.2220
}
]
}
]
}