Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f50434112a9ef47f0c34da3ae6fb2df5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 88.368,
"b": 57.469,
"c": 32.688,
"alpha": 90.00,
"beta": 91.09,
"gamma": 90.00
},
"wavelengths": [0.92201],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.17,1.44],
"number_observations": 187195,
"number_observations_unique": 29070,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.131
},
{
"type": "R(meas)",
"value": 0.143
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 5.8
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.47,1.44],
"number_observations": 6630,
"number_observations_unique": 1372,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.300
},
{
"type": "R(meas)",
"value": 3.700
},
{
"type": "R(pim)",
"value": 1.644
},
{
"type": "I/SigI",
"value": 0.1
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.261
}
]
}
]
}