Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bde5ca9e10b0d33ff376cc53d53e2403",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.281,
"b": 33.379,
"c": 60.358,
"alpha": 90.00,
"beta": 95.81,
"gamma": 90.00
},
"wavelengths": [0.92120],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.04,1.15],
"number_observations": 209734,
"number_observations_unique": 36815,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 20.2
},
{
"type": "Completeness",
"value": 69.9
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.15],
"number_observations": 164,
"number_observations_unique": 155,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.228
},
{
"type": "R(meas)",
"value": 0.322
},
{
"type": "R(pim)",
"value": 0.228
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 1.1
},
{
"type": "CC(1/2)",
"value": 0.947
}
]
}
]
}