Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "8b0f03261618b3af57460d6e706c1de9",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 35.792,
"b": 65.035,
"c": 73.619,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.11600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.74,1.62],
"number_observations": 137196,
"number_observations_unique": 21619,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 17.2
},
{
"type": "Completeness",
"value": 96.6
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.65,1.62],
"number_observations": 3906,
"number_observations_unique": 780,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.672
},
{
"type": "R(meas)",
"value": 1.852
},
{
"type": "R(pim)",
"value": 0.775
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.364
}
]
}
]
}