Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "455c249cddf54f730012d4c19dcf390b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.003,
"b": 53.042,
"c": 112.201,
"alpha": 90.00,
"beta": 101.65,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.77,2.15],
"number_observations": 99970,
"number_observations_unique": 28877,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "R(meas)",
"value": 0.236
},
{
"type": "R(pim)",
"value": 0.124
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [2.21,2.15],
"number_observations": 7630,
"number_observations_unique": 2304,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.382
},
{
"type": "R(meas)",
"value": 1.629
},
{
"type": "R(pim)",
"value": 0.849
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.328
}
]
}
]
}