Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8e80c866b1c534e8b6b87f953b296166",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 51.966,
"b": 84.212,
"c": 94.977,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.490,2.300],
"number_observations": 230764,
"number_observations_unique": 17684,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.255
},
{
"type": "R(meas)",
"value": 0.266
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 9.600
},
{
"type": "Completeness",
"value": 91.800
},
{
"type": "Redundancy",
"value": 13.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.380,2.300],
"number_observations": 17208,
"number_observations_unique": 1800,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.577
},
{
"type": "R(meas)",
"value": 1.666
},
{
"type": "R(pim)",
"value": 0.524
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 9.600
},
{
"type": "CC(1/2)",
"value": 0.690
}
]
},
{
"resolution_limits": [47.490,8.900],
"number_observations": 4126,
"number_observations_unique": 395,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 32.500
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 10.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}