Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "8eea745a1fc12c72ffd6ab1cbeef4ea6",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.764,
"b": 88.764,
"c": 39.504,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.77488],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.380,0.990],
"number_observations": 1154179,
"number_observations_unique": 170954,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 16.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 55794,
"number_observations_unique": 8373,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.754
},
{
"type": "R(meas)",
"value": 2.988
},
{
"type": "R(pim)",
"value": 1.149
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.347
}
]
},
{
"resolution_limits": [44.380,5.420],
"number_observations": 7549,
"number_observations_unique": 1133,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 66.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}