Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cddb493cabbfba1d12a0b09c10778054",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 131.141,
"b": 131.141,
"c": 290.657,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.46000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.740,2.850],
"number_observations": 195360,
"number_observations_unique": 22740,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.290
},
{
"type": "R(meas)",
"value": 0.309
},
{
"type": "R(pim)",
"value": 0.105
},
{
"type": "I/SigI",
"value": 8.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 8.600
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [3.000,2.850],
"number_observations": 24398,
"number_observations_unique": 3259,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.648
},
{
"type": "R(meas)",
"value": 1.772
},
{
"type": "R(pim)",
"value": 0.643
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.500
},
{
"type": "CC(1/2)",
"value": 0.536
}
]
},
{
"resolution_limits": [44.740,9.010],
"number_observations": 6127,
"number_observations_unique": 769,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 33.000
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 8.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}