Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "75ee79bbe14c2bfbb0a7834e12b0a9ef",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 60.470,
"b": 100.156,
"c": 132.859,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.230,2.0890],
"number_observations_unique": 48375,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "R(meas)",
"value": 0.143
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 13.000
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 13.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.150,2.090],
"number_observations": 38818,
"number_observations_unique": 3372,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.629
},
{
"type": "R(meas)",
"value": 0.657
},
{
"type": "R(pim)",
"value": 0.187
},
{
"type": "I/SigI",
"value": 4.100
},
{
"type": "Completeness",
"value": 91.000
},
{
"type": "Redundancy",
"value": 11.500
},
{
"type": "CC(1/2)",
"value": 0.853
}
]
},
{
"resolution_limits": [48.230,9.100],
"number_observations": 8292,
"number_observations_unique": 690,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 23.800
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 12.000
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}