Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6cd2ccfd461b2308773fc6df71606c21",
"space_group_name": "P 65",
"unit_cell": {
"a": 122.005,
"b": 122.005,
"c": 102.263,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.27110],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.94,3.30],
"number_observations_unique": 12599,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.135
},
{
"type": "R(meas)",
"value": 0.143
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 18.6
},
{
"type": "Completeness",
"value": 96.1
},
{
"type": "Redundancy",
"value": 17.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [46.94,8.73],
"number_observations_unique": 733,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "Redundancy",
"value": 15.8
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [3.57,3.30],
"number_observations_unique": 2650,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.461
},
{
"type": "R(meas)",
"value": 2.608
},
{
"type": "R(pim)",
"value": 0.860
},
{
"type": "Redundancy",
"value": 17.9
},
{
"type": "CC(1/2)",
"value": 0.677
}
]
}
]
}