Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8ab44633b6f88563a40c52f2240d3ad8",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.919,
"b": 53.069,
"c": 44.555,
"alpha": 90.00,
"beta": 102.55,
"gamma": 90.00
},
"wavelengths": [0.91259],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.04,1.62],
"number_observations": 97479,
"number_observations_unique": 32616,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.64,1.62],
"number_observations": 3828,
"number_observations_unique": 1576,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.016
},
{
"type": "R(meas)",
"value": 1.289
},
{
"type": "R(pim)",
"value": 0.785
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.412
}
]
}
]
}