Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "58470d3475cfe926dfeec69e1437f7a9",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 53.39,
"b": 48.56,
"c": 78.77,
"alpha": 90.00,
"beta": 97.98,
"gamma": 90.00
},
"wavelengths": [0.99997],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.22,1.80],
"number_observations_unique": 37165,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 17.93
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.85,1.80],
"number_observations_unique": 2758,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.727
},
{
"type": "R(meas)",
"value": 0.791
},
{
"type": "I/SigI",
"value": 1.85
},
{
"type": "CC(1/2)",
"value": 0.925
}
]
}
]
}