Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7b72749d2fb249a17dd52f0500fa3d74",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.081,
"b": 53.290,
"c": 44.526,
"alpha": 90.00,
"beta": 102.53,
"gamma": 90.00
},
"wavelengths": [0.91261],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.83,1.73],
"number_observations": 87561,
"number_observations_unique": 26937,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 11.9
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.73],
"number_observations": 4817,
"number_observations_unique": 1418,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.356
},
{
"type": "R(meas)",
"value": 1.618
},
{
"type": "R(pim)",
"value": 0.872
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.206
}
]
}
]
}