Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "343f566d6c0c3a8c6ec7ce75f49bdd45",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 63.762,
"b": 79.750,
"c": 103.893,
"alpha": 90.00,
"beta": 90.19,
"gamma": 90.00
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.95,2.88],
"number_observations_unique": 45562,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.176
},
{
"type": "R(meas)",
"value": 0.191
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 7.2
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [3.06,2.88],
"number_observations_unique": 3629,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.266
},
{
"type": "R(meas)",
"value": 1.370
},
{
"type": "R(pim)",
"value": 0.517
},
{
"type": "I/SigI",
"value": 7.2
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.710
}
]
}
]
}