Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "f6a7496f88d4ca4ac3b87dc6cb96ecfe",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 54.582,
"b": 58.161,
"c": 66.644,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.68879],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.82,0.987],
"number_observations_unique": 106327,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 14.2
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [43.82,2.844],
"number_observations_unique": 5316,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.01
},
{
"type": "I/SigI",
"value": 58
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.043,0.987],
"number_observations_unique": 5316,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.021
},
{
"type": "R(meas)",
"value": 2.096
},
{
"type": "R(pim)",
"value": 0.553
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 75.6
},
{
"type": "Redundancy",
"value": 14.2
},
{
"type": "CC(1/2)",
"value": 0.6
}
]
}
]
}