Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1f9e8aff8ca58e1f8bbfc83273f78c65",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 109.009,
"b": 178.914,
"c": 88.078,
"alpha": 90.00,
"beta": 107.12,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [89.46,2.00],
"number_observations": 232533,
"number_observations_unique": 103502,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "R(meas)",
"value": 0.166
},
{
"type": "R(pim)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 9.4
},
{
"type": "Completeness",
"value": 95.6
},
{
"type": "Redundancy",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
"refln_shells": [
{
"resolution_limits": [2.03,2.00],
"number_observations": 11044,
"number_observations_unique": 5121,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.768
},
{
"type": "R(meas)",
"value": 1.003
},
{
"type": "R(pim)",
"value": 0.638
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Redundancy",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.412
}
]
}
]
}