Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9a9e347ceb43a5711353b780754d8a22",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 137.601,
"b": 65.565,
"c": 84.330,
"alpha": 90.0,
"beta": 93.4,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [68.660,2.380],
"number_observations": 101439,
"number_observations_unique": 30244,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.324
},
{
"type": "R(meas)",
"value": 0.386
},
{
"type": "R(pim)",
"value": 0.208
},
{
"type": "I/SigI",
"value": 3.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.939
}
]
},
"refln_shells": [
{
"resolution_limits": [2.440,2.380],
"number_observations": 7036,
"number_observations_unique": 2203,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.214
},
{
"type": "R(meas)",
"value": 1.462
},
{
"type": "R(pim)",
"value": 0.807
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.399
}
]
},
{
"resolution_limits": [68.660,10.640],
"number_observations": 1262,
"number_observations_unique": 363,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}