Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e87e919aa8b27490bbad74890e8cf018",
"space_group_name": "P 1",
"unit_cell": {
"a": 97.150,
"b": 97.435,
"c": 100.710,
"alpha": 77.06,
"beta": 78.19,
"gamma": 68.92
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.62,1.375],
"number_observations_unique": 528663,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 76.4
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.9978
}
]
},
"refln_shells": [
{
"resolution_limits": [1.481,1.375],
"number_observations_unique": 26426,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.811
},
{
"type": "R(meas)",
"value": 0.966
},
{
"type": "R(pim)",
"value": 0.518
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 19.1
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.498
}
]
}
]
}