Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ff90ad21d0eeeb1303b202312b229f35",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 54.479,
"b": 101.880,
"c": 131.338,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.040,1.700],
"number_observations": 294083,
"number_observations_unique": 70070,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 87.000
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.700],
"number_observations": 13739,
"number_observations_unique": 3510,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.614
},
{
"type": "R(pim)",
"value": 0.324
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 83.400
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.755
}
]
},
{
"resolution_limits": [48.040,9.000],
"number_observations": 2496,
"number_observations_unique": 519,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 30.500
},
{
"type": "Completeness",
"value": 82.800
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}