Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "322e4e73a50432685f0ea44a9960da55",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.475,
"b": 86.694,
"c": 152.642,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92820],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [76.420,2.557],
"number_observations_unique": 29622,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.203
},
{
"type": "R(meas)",
"value": 0.233
},
{
"type": "R(pim)",
"value": 0.112
},
{
"type": "I/SigI",
"value": 4.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.971
}
]
},
"refln_shells": [
{
"resolution_limits": [2.630,2.560],
"number_observations_unique": 2167,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.278
},
{
"type": "R(meas)",
"value": 1.486
},
{
"type": "R(pim)",
"value": 0.742
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.473
}
]
},
{
"resolution_limits": [76.420,11.450],
"number_observations_unique": 407,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}