Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4f176ed1233e1cc381833722bde8c10d",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 73.495,
"b": 73.495,
"c": 174.472,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91841],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.930,2.020],
"number_observations": 136596,
"number_observations_unique": 35142,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 8.000
},
{
"type": "Completeness",
"value": 95.800
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.070,2.020],
"number_observations": 4958,
"number_observations_unique": 2044,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.307
},
{
"type": "R(pim)",
"value": 0.202
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 76.300
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.851
}
]
},
{
"resolution_limits": [42.930,9.030],
"number_observations": 2321,
"number_observations_unique": 486,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 17.600
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}