Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6725d4e22c80c8c7e2d65ce4cffa1e78",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 41.30,
"b": 54.24,
"c": 87.29,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.65,1.590],
"number_observations_unique": 26921,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 12.000
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 12.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.590],
"number_observations_unique": 1527,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.379
},
{
"type": "R(meas)",
"value": 1.454
},
{
"type": "R(pim)",
"value": 0.445
},
{
"type": "Completeness",
"value": 77.800
},
{
"type": "Redundancy",
"value": 9.300
},
{
"type": "CC(1/2)",
"value": 0.655
}
]
},
{
"resolution_limits": [43.65,7.090],
"number_observations_unique": 375,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 10.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}