Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "17ad1a55e7c994978a0ebe589352b1a4",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 131.34,
"b": 131.34,
"c": 47.37,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [92.87,1.74],
"number_observations_unique": 43146,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.184
},
{
"type": "R(meas)",
"value": 0.191
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 10.5
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 26.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [92.87,9.04],
"number_observations_unique": 390,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 40.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 20.9
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [1.77,1.74],
"number_observations_unique": 2330,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.524
},
{
"type": "R(meas)",
"value": 4.702
},
{
"type": "R(pim)",
"value": 1.277
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 25.6
},
{
"type": "CC(1/2)",
"value": 0.417
}
]
}
]
}