Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ed540cd7bde083a040b95473039ab4ce",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.19,
"b": 72.95,
"c": 67.88,
"alpha": 90.00,
"beta": 102.48,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.280,2.300],
"number_observations": 91536,
"number_observations_unique": 19342,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 6.700
},
{
"type": "Completeness",
"value": 94.500
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.390,2.300],
"number_observations": 9420,
"number_observations_unique": 1988,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.165
},
{
"type": "R(pim)",
"value": 0.576
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 93.600
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.639
}
]
},
{
"resolution_limits": [66.280,8.610],
"number_observations": 1863,
"number_observations_unique": 386,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 14.900
},
{
"type": "Completeness",
"value": 93.700
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}