Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cbc3b9fca86f8131f99b34d31486a950",
"space_group_name": "I 21 21 21",
"unit_cell": {
"a": 80.586,
"b": 147.886,
"c": 152.054,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97856],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.95,2.15],
"number_observations": 680729,
"number_observations_unique": 49721,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 21.9
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.22,2.15],
"number_observations": 61863,
"number_observations_unique": 4272,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.485
},
{
"type": "R(meas)",
"value": 1.539
},
{
"type": "R(pim)",
"value": 0.403
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Redundancy",
"value": 14.5
},
{
"type": "CC(1/2)",
"value": 0.768
}
]
}
]
}