Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "42774552007328d6a5de38f61e097284",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 72.346,
"b": 103.109,
"c": 86.867,
"alpha": 90.00,
"beta": 101.24,
"gamma": 90.00
},
"wavelengths": [0.97933],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.96,2.99],
"number_observations_unique": 25232,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.203
},
{
"type": "R(meas)",
"value": 0.243
},
{
"type": "R(pim)",
"value": 0.132
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.925
}
]
},
"refln_shells": [
{
"resolution_limits": [3.18,3.00],
"number_observations": 12858,
"number_observations_unique": 4006,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.670
},
{
"type": "R(meas)",
"value": 0.806
},
{
"type": "R(pim)",
"value": 0.443
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.548
}
]
}
]
}