Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a7fc6452f2047702e279e362cd6a1f5e",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 154.068,
"b": 197.300,
"c": 229.680,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.63,2.18],
"number_observations": 2475202,
"number_observations_unique": 181027,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.178
},
{
"type": "R(meas)",
"value": 0.185
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 12.9
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.24,2.18],
"number_observations": 186105,
"number_observations_unique": 13326,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.830
},
{
"type": "R(meas)",
"value": 1.899
},
{
"type": "R(pim)",
"value": 0.506
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Redundancy",
"value": 14.0
},
{
"type": "CC(1/2)",
"value": 0.691
}
]
}
]
}