Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "18d08cd6757ba891e50d1e32b85df1ce",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 34.297,
"b": 45.552,
"c": 99.035,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.89200],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.52,1.70],
"number_observations_unique": 27966,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1012
},
{
"type": "R(meas)",
"value": 0.1026
},
{
"type": "R(pim)",
"value": 0.01671
},
{
"type": "I/SigI",
"value": 30.18
},
{
"type": "Completeness",
"value": 85.52
},
{
"type": "Redundancy",
"value": 29.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.77,1.70],
"number_observations_unique": 720,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2227
},
{
"type": "R(meas)",
"value": 0.2512
},
{
"type": "R(pim)",
"value": 0.1143
},
{
"type": "I/SigI",
"value": 4.42
},
{
"type": "Completeness",
"value": 22.11
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.945
}
]
}
]
}