Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "46790bc0757a6ebe3aba6ed96b683265",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 51.80,
"b": 109.51,
"c": 53.75,
"alpha": 90.00,
"beta": 93.93,
"gamma": 90.00
},
"wavelengths": [0.97627],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [109.51,1.91],
"number_observations_unique": 46333,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.16
},
{
"type": "R(pim)",
"value": 0.06
},
{
"type": "I/SigI",
"value": 7.6
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 1.00
}
]
},
"refln_shells": [
{
"resolution_limits": [1.95,1.91],
"number_observations_unique": 3079,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.02
},
{
"type": "R(pim)",
"value": 0.42
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.78
}
]
}
]
}