Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bb2e4e6e7ddd403b3b333dc45e40d3ea",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.633,
"b": 57.409,
"c": 64.748,
"alpha": 90.0,
"beta": 94.9,
"gamma": 90.0
},
"wavelengths": [0.92199],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.16,1.15],
"number_observations": 451727,
"number_observations_unique": 84631,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 31.1
},
{
"type": "Completeness",
"value": 75.6
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.15],
"number_observations": 318,
"number_observations_unique": 316,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.409
},
{
"type": "R(meas)",
"value": 0.578
},
{
"type": "R(pim)",
"value": 0.409
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Redundancy",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.893
}
]
}
]
}