Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f7419c94f0127762c4392a4e8b0547fb",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 82.320,
"b": 116.014,
"c": 147.204,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [91.16,1.86],
"number_observations": 811183,
"number_observations_unique": 59380,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.227
},
{
"type": "R(meas)",
"value": 0.236
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 6.3
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.90,1.86],
"number_observations": 51669,
"number_observations_unique": 3733,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.985
},
{
"type": "R(meas)",
"value": 6.214
},
{
"type": "R(pim)",
"value": 1.665
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 13.8
},
{
"type": "CC(1/2)",
"value": 0.323
}
]
}
]
}