Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "79eba1c74df52851fff86f2079431ddb",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 74.360,
"b": 74.360,
"c": 174.679,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91841],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.670,1.720],
"number_observations": 364165,
"number_observations_unique": 60326,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 17.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.720],
"number_observations": 17595,
"number_observations_unique": 3059,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.763
},
{
"type": "R(pim)",
"value": 0.345
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.729
}
]
},
{
"resolution_limits": [43.670,9.100],
"number_observations": 2362,
"number_observations_unique": 484,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 61.500
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}