Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cab90f7ac2697cad323c4dbee5708d52",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 93.870,
"b": 48.816,
"c": 109.333,
"alpha": 90.00,
"beta": 110.66,
"gamma": 90.00
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.920,1.5260],
"number_observations_unique": 68100,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.208
},
{
"type": "R(meas)",
"value": 0.230
},
{
"type": "R(pim)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 7.700
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.916
}
]
},
"refln_shells": [
{
"resolution_limits": [1.610,1.530],
"number_observations_unique": 9886,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.852
},
{
"type": "R(meas)",
"value": 0.932
},
{
"type": "R(pim)",
"value": 0.372
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.699
}
]
},
{
"resolution_limits": [43.920,4.830],
"number_observations_unique": 2301,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "R(meas)",
"value": 0.170
},
{
"type": "R(pim)",
"value": 0.067
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.968
}
]
}
]
}