Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a5c174ac104750202f1d077577f136b0",
"space_group_name": "P 1",
"unit_cell": {
"a": 38.1,
"b": 48.3,
"c": 69.1,
"alpha": 93.7,
"beta": 87.3,
"gamma": 97.5
},
"wavelengths": [0.97800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.58,2.4],
"number_observations_unique": 17894,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 9.59
},
{
"type": "Completeness",
"value": 93.47
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.486,2.4],
"number_observations_unique": 1813,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.47
},
{
"type": "R(meas)",
"value": 0.55
},
{
"type": "R(pim)",
"value": 0.29
},
{
"type": "I/SigI",
"value": 2.13
},
{
"type": "Completeness",
"value": 96.37
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.926
}
]
}
]
}