Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "559fa25230fe017263faad91028d8683",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.754,
"b": 99.036,
"c": 101.986,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88560],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.52,1.80],
"number_observations_unique": 64002,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 16.1
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 10.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.84,1.80],
"number_observations_unique": 3564,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.461
},
{
"type": "R(meas)",
"value": 1.726
},
{
"type": "R(pim)",
"value": 0.603
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.485
}
]
}
]
}