Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0b7f6be5ed6ccd96a19c9f92a7ead388",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 47.844,
"b": 47.879,
"c": 92.233,
"alpha": 90.000,
"beta": 90.053,
"gamma": 90.000
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.844,1.68],
"number_observations_unique": 43877,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.094
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 25.4
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 23.7
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.71,1.68],
"number_observations": 12710,
"number_observations_unique": 639,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.256
},
{
"type": "R(meas)",
"value": 1.289
},
{
"type": "R(pim)",
"value": 0.287
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Redundancy",
"value": 19.9
},
{
"type": "CC(1/2)",
"value": 0.840
}
]
}
]
}