Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d05ea8d74694cde76d241979cf2b9fa2",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 42.054,
"b": 67.152,
"c": 107.244,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.9,1.69],
"number_observations_unique": 33746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.12
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [1.72,1.69],
"number_observations_unique": 1702,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.446
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.375
}
]
}
]
}