Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "663dc69436c502c0eb7c30dbe26ef8b9",
"space_group_name": "P 1",
"unit_cell": {
"a": 72.359,
"b": 76.238,
"c": 82.599,
"alpha": 116.56,
"beta": 94.91,
"gamma": 102.75
},
"wavelengths": [0.97934],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.76,2.42],
"number_observations_unique": 102736,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.118
},
{
"type": "R(pim)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 9.4
},
{
"type": "Completeness",
"value": 98.0
},
{
"type": "Redundancy",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
},
"refln_shells": [
{
"resolution_limits": [2.45,2.42],
"number_observations_unique": 2744,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.392
},
{
"type": "R(meas)",
"value": 0.554
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 94.4
},
{
"type": "Redundancy",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.753
}
]
}
]
}