Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4a4c3d4da97b01a7e2a61c18d40b9e7a",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.304,
"b": 71.304,
"c": 150.150,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.350,1.830],
"number_observations": 455402,
"number_observations_unique": 35032,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 24.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.870,1.830],
"number_observations": 26809,
"number_observations_unique": 2077,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.840
},
{
"type": "R(meas)",
"value": 0.874
},
{
"type": "R(pim)",
"value": 0.238
},
{
"type": "I/SigI",
"value": 3.300
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 12.900
},
{
"type": "CC(1/2)",
"value": 0.867
}
]
},
{
"resolution_limits": [29.350,8.970],
"number_observations": 3815,
"number_observations_unique": 363,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.026
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 82.200
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 10.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}