Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "38270c73c7a6a8ac13fe3cf67f065b0c",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 54.6,
"b": 54.6,
"c": 185.3,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97853],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.280,2.000],
"number_observations": 417639,
"number_observations_unique": 22446,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 27.200
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 18.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"number_observations": 32151,
"number_observations_unique": 1628,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.533
},
{
"type": "R(meas)",
"value": 1.573
},
{
"type": "R(pim)",
"value": 0.352
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.700
},
{
"type": "CC(1/2)",
"value": 0.918
}
]
},
{
"resolution_limits": [47.280,8.950],
"number_observations": 4585,
"number_observations_unique": 322,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 68.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 14.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}