Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "4b811ed1efc13f9002dd23526750cf6b",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 102.548,
"b": 102.548,
"c": 139.948,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.6,2.0],
"number_observations_unique": 29686,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 29.3
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 24.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.03,2.0],
"number_observations_unique": 2853,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.390
},
{
"type": "R(meas)",
"value": 1.419
},
{
"type": "R(pim)",
"value": 0.286
},
{
"type": "I/SigI",
"value": 3.30
},
{
"type": "CC(1/2)",
"value": 0.882
}
]
}
]
}