Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "392676ae5563d91eb64d2df8b3ae8ab7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 74.275,
"b": 77.350,
"c": 96.531,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.36,1.80],
"number_observations": 648930,
"number_observations_unique": 52210,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.175
},
{
"type": "R(meas)",
"value": 0.182
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 7.1
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 12.4
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.84,1.80],
"number_observations_unique": 3060,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.156
},
{
"type": "R(pim)",
"value": 0.338
},
{
"type": "Redundancy",
"value": 12.7
},
{
"type": "CC(1/2)",
"value": 0.896
}
]
}
]
}