Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "506b25926987450e155d3e852606ca96",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 41.906,
"b": 54.933,
"c": 56.820,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.72933],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.910,0.890],
"number_observations": 659976,
"number_observations_unique": 91415,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "R(meas)",
"value": 0.119
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 13.700
},
{
"type": "Completeness",
"value": 89.500
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [0.900,0.890],
"number_observations": 2675,
"number_observations_unique": 1145,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.250
},
{
"type": "R(meas)",
"value": 0.305
},
{
"type": "R(pim)",
"value": 0.171
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 23.100
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.896
}
]
},
{
"resolution_limits": [41.910,4.860],
"number_observations": 8505,
"number_observations_unique": 737,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "R(meas)",
"value": 0.128
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 23.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.500
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}