Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e296bff8242a325740e194e2875f7a2d",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 64.665,
"b": 119.140,
"c": 66.100,
"alpha": 90.00,
"beta": 92.55,
"gamma": 90.00
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.000,2.200],
"number_observations": 72379,
"number_observations_unique": 24924,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.200],
"number_observations": 4875,
"number_observations_unique": 1966,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.581
},
{
"type": "R(pim)",
"value": 0.432
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 90.200
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.740
}
]
},
{
"resolution_limits": [36.000,9.070],
"number_observations": 976,
"number_observations_unique": 337,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.015
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 76.600
},
{
"type": "Completeness",
"value": 89.100
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}