Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "27b85be8a4c5d94321f9bb71cc02ab6a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 49.409,
"b": 111.045,
"c": 66.491,
"alpha": 90.000,
"beta": 98.044,
"gamma": 90.000
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,2.30],
"number_observations_unique": 31125,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(meas)",
"value": 0.150
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 15.087
},
{
"type": "Completeness",
"value": 98.41
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.35,2.31],
"number_observations_unique": 2948,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.550
},
{
"type": "R(meas)",
"value": 0.607
},
{
"type": "R(pim)",
"value": 0.253
},
{
"type": "I/SigI",
"value": 2.833
},
{
"type": "Completeness",
"value": 93.5
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.844
}
]
}
]
}