Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0af0805de37a6892a7af802d69965086",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 75.35,
"b": 109.11,
"c": 118.05,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [63.510,1.980],
"number_observations": 488655,
"number_observations_unique": 68333,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "R(pim)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.030,1.980],
"number_observations": 29274,
"number_observations_unique": 4478,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.216
},
{
"type": "R(pim)",
"value": 0.509
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.522
}
]
},
{
"resolution_limits": [63.510,9.290],
"number_observations": 4587,
"number_observations_unique": 761,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 25.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}