Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "52a00ae97717efc065eeb1b5224c65c9",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 35.905,
"b": 65.167,
"c": 73.648,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.11600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.80,1.56],
"number_observations": 154590,
"number_observations_unique": 25099,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 13.7
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.59,1.56],
"number_observations": 5466,
"number_observations_unique": 1143,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.662
},
{
"type": "R(meas)",
"value": 1.868
},
{
"type": "R(pim)",
"value": 0.838
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.397
}
]
}
]
}