Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "72c8fb7ed7e1a88519039afe248868d3",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.613,
"b": 34.907,
"c": 61.315,
"alpha": 90.000,
"beta": 101.519,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.08,1.60],
"number_observations_unique": 24665,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.130
},
{
"type": "R(meas)",
"value": 0.136
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 13.9
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 12.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [60.08,8.76],
"number_observations_unique": 171,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 33.6
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 12.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.63,1.60],
"number_observations_unique": 1143,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.126
},
{
"type": "R(meas)",
"value": 2.261
},
{
"type": "R(pim)",
"value": 0.749
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 95.9
},
{
"type": "Redundancy",
"value": 8.6
},
{
"type": "CC(1/2)",
"value": 0.700
}
]
}
]
}