Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dba0a58a1ef7eb9000fef44f5fd56137",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.382,
"b": 71.256,
"c": 61.396,
"alpha": 90.0,
"beta": 104.9,
"gamma": 90.0
},
"wavelengths": [0.99998],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.595,1.9],
"number_observations_unique": 29127,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "R(meas)",
"value": 0.134
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 11.5
},
{
"type": "Completeness",
"value": 99.62
},
{
"type": "Redundancy",
"value": 12.7
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.968,1.9],
"number_observations_unique": 2819,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.319
},
{
"type": "R(meas)",
"value": 1.401
},
{
"type": "R(pim)",
"value": 0.464
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 96.44
},
{
"type": "Redundancy",
"value": 8.7
},
{
"type": "CC(1/2)",
"value": 0.65
}
]
}
]
}