Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "f6dab07fd1f92917009ade7c6320f0de",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 91.280,
"b": 52.342,
"c": 87.673,
"alpha": 90.00,
"beta": 110.68,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [82.02,1.09],
"number_observations": 475758,
"number_observations_unique": 158636,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 11.6
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
"refln_shells": [
{
"resolution_limits": [1.12,1.09],
"number_observations": 21512,
"number_observations_unique": 11009,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.492
},
{
"type": "R(meas)",
"value": 0.650
},
{
"type": "R(pim)",
"value": 0.420
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.682
}
]
}
]
}