Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b03571cad4be13424f07406fedcdb767",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 30.606,
"b": 72.113,
"c": 55.044,
"alpha": 90.000,
"beta": 104.875,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.2,1.17],
"number_observations_unique": 37874,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 21.5
},
{
"type": "Completeness",
"value": 96.65
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.23,1.17],
"number_observations_unique": 4717,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "R(meas)",
"value": 0.204
},
{
"type": "R(pim)",
"value": 0.135
},
{
"type": "I/SigI",
"value": 4.4
},
{
"type": "Completeness",
"value": 82.73
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.90
}
]
}
]
}