Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "04d4ead269bbe8df8ff96f7ea33d1d52",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 64.747,
"b": 118.650,
"c": 66.066,
"alpha": 90.00,
"beta": 92.52,
"gamma": 90.00
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.020,2.300],
"number_observations": 45045,
"number_observations_unique": 21307,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.380,2.300],
"number_observations": 3867,
"number_observations_unique": 1910,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.536
},
{
"type": "R(pim)",
"value": 0.483
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 89.200
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.719
}
]
},
{
"resolution_limits": [29.020,8.910],
"number_observations": 731,
"number_observations_unique": 350,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.012
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 77.600
},
{
"type": "Completeness",
"value": 87.700
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}