Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e2bbabaf4ff748b99017b591c81a739d",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 57.84,
"b": 57.84,
"c": 122.73,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.320,1.820],
"number_observations": 232626,
"number_observations_unique": 17317,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 16.800
},
{
"type": "Completeness",
"value": 88.300
},
{
"type": "Redundancy",
"value": 13.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.860,1.820],
"number_observations": 14581,
"number_observations_unique": 1131,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.246
},
{
"type": "R(pim)",
"value": 0.359
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.900
},
{
"type": "CC(1/2)",
"value": 0.819
}
]
},
{
"resolution_limits": [52.320,9.090],
"number_observations": 1976,
"number_observations_unique": 211,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 42.800
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 9.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}