Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "44bb96da4100e3df43b8d3c29683f48c",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.803,
"b": 88.803,
"c": 39.497,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.400,0.980],
"number_observations": 1101098,
"number_observations_unique": 176083,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 12.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.000,0.980],
"number_observations": 29358,
"number_observations_unique": 8312,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.628
},
{
"type": "R(meas)",
"value": 1.907
},
{
"type": "R(pim)",
"value": 0.966
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.403
}
]
},
{
"resolution_limits": [44.400,5.370],
"number_observations": 8093,
"number_observations_unique": 1166,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 45.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}