Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7365b4912b4b20f6b4db1d28af4030b9",
"space_group_name": "P 1",
"unit_cell": {
"a": 46.04,
"b": 46.04,
"c": 46.10,
"alpha": 104.250,
"beta": 104.339,
"gamma": 104.167
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.22,2.60],
"number_observations_unique": 18980,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05211
},
{
"type": "R(meas)",
"value": 0.06271
},
{
"type": "R(pim)",
"value": 0.03422
},
{
"type": "I/SigI",
"value": 14.14
},
{
"type": "Completeness",
"value": 95.08
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.693,2.60],
"number_observations_unique": 2992,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5293
},
{
"type": "R(meas)",
"value": 0.6483
},
{
"type": "R(pim)",
"value": 0.3662
},
{
"type": "I/SigI",
"value": 2.19
},
{
"type": "Completeness",
"value": 94.64
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.709
}
]
}
]
}