Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8ff13b9e902560094ca11dd0f9a68a23",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.419,
"b": 73.767,
"c": 109.512,
"alpha": 90.000,
"beta": 92.397,
"gamma": 90.000
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.4,1.80],
"number_observations_unique": 66678,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(meas)",
"value": 0.134
},
{
"type": "R(pim)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 19.1
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [1.83,1.80],
"number_observations_unique": 2899,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.559
},
{
"type": "R(meas)",
"value": 0.680
},
{
"type": "R(pim)",
"value": 0.377
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 86.5
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.661
}
]
}
]
}