Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7f3c65a82803af35e857837917bc4051",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 34.681,
"b": 35.280,
"c": 53.647,
"alpha": 90.00,
"beta": 105.57,
"gamma": 90.00
},
"wavelengths": [1.18064],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.280,1.430],
"number_observations": 72959,
"number_observations_unique": 23092,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 10.300
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.450,1.430],
"number_observations": 3696,
"number_observations_unique": 1166,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.042
},
{
"type": "R(meas)",
"value": 1.250
},
{
"type": "R(pim)",
"value": 0.681
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.346
}
]
},
{
"resolution_limits": [35.280,7.830],
"number_observations": 491,
"number_observations_unique": 162,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 25.800
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}