Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "830ec41d31da42cbb5d4dce15be5c0a0",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 93.902,
"b": 93.902,
"c": 33.232,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.99980],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.320,2.250],
"number_observations": 150785,
"number_observations_unique": 8214,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.131
},
{
"type": "R(meas)",
"value": 0.135
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 18.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.320,2.250],
"number_observations": 11363,
"number_observations_unique": 750,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.375
},
{
"type": "R(meas)",
"value": 1.425
},
{
"type": "R(pim)",
"value": 0.366
},
{
"type": "I/SigI",
"value": 2.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 15.200
},
{
"type": "CC(1/2)",
"value": 0.865
}
]
},
{
"resolution_limits": [81.320,9.000],
"number_observations": 2223,
"number_observations_unique": 148,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 59.700
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 15.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}