Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a3455fb67bf0a0ac9d1d7852dd164288",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 75.259,
"b": 80.248,
"c": 40.361,
"alpha": 90.00,
"beta": 95.45,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.18,1.20],
"number_observations": 248305,
"number_observations_unique": 74030,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations": 12004,
"number_observations_unique": 3781,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.457
},
{
"type": "R(meas)",
"value": 0.549
},
{
"type": "R(pim)",
"value": 0.301
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.895
}
]
}
]
}