Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "80881166675572e125d11859789bc6a2",
"space_group_name": "C 2 2 2",
"unit_cell": {
"a": 142.396,
"b": 147.327,
"c": 74.758,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.430,1.700],
"number_observations": 1108041,
"number_observations_unique": 84958,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 17.500
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 13.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.700],
"number_observations": 60509,
"number_observations_unique": 4390,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.197
},
{
"type": "R(meas)",
"value": 1.243
},
{
"type": "R(pim)",
"value": 0.333
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 13.800
},
{
"type": "CC(1/2)",
"value": 0.897
}
]
},
{
"resolution_limits": [46.430,9.000],
"number_observations": 8188,
"number_observations_unique": 663,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 43.400
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}