Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "899bf283e0964f84b118aefb3a0ea274",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.609,
"b": 42.609,
"c": 216.395,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [216.400,1.950],
"number_observations": 393855,
"number_observations_unique": 15555,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.325
},
{
"type": "R(meas)",
"value": 0.332
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.070,1.950],
"number_observations": 65553,
"number_observations_unique": 2432,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.796
},
{
"type": "R(meas)",
"value": 9.981
},
{
"type": "R(pim)",
"value": 1.899
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 27.000
},
{
"type": "CC(1/2)",
"value": 0.431
}
]
},
{
"resolution_limits": [216.400,5.860],
"number_observations": 14390,
"number_observations_unique": 720,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 28.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}