Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "efb17520550efb43750582f1c8de875e",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 125.726,
"b": 203.355,
"c": 208.266,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.74013],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.390,2.000],
"number_observations": 2270196,
"number_observations_unique": 356578,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.121
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 10.800
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.030,2.000],
"number_observations": 77503,
"number_observations_unique": 16571,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.815
},
{
"type": "R(pim)",
"value": 0.408
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 94.100
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.609
}
]
},
{
"resolution_limits": [49.390,10.950],
"number_observations": 16223,
"number_observations_unique": 2396,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 29.700
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}