Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a71fc97544aa027d53b46e660769c736",
"space_group_name": "P 62 2 2",
"unit_cell": {
"a": 102.861,
"b": 102.861,
"c": 244.533,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97850],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.865,2.800],
"number_observations_unique": 16874,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 11.100
},
{
"type": "Completeness",
"value": 92.000
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.950,2.800],
"number_observations": 5044,
"number_observations_unique": 2615,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.153
},
{
"type": "R(meas)",
"value": 0.217
},
{
"type": "R(pim)",
"value": 0.153
},
{
"type": "I/SigI",
"value": 3.700
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.938
}
]
},
{
"resolution_limits": [19.860,8.850],
"number_observations": 825,
"number_observations_unique": 453,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 23.100
},
{
"type": "Completeness",
"value": 72.800
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}