Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d93d213abe47e4dacf874bfa55ea9419",
"space_group_name": "P 1",
"unit_cell": {
"a": 34.737,
"b": 52.285,
"c": 57.568,
"alpha": 74.16,
"beta": 76.27,
"gamma": 84.60
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.010,1.900],
"number_observations": 90694,
"number_observations_unique": 28514,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(meas)",
"value": 0.126
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 5.200
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.900],
"number_observations_unique": 1415,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.367
},
{
"type": "R(meas)",
"value": 0.443
},
{
"type": "R(pim)",
"value": 0.245
},
{
"type": "Completeness",
"value": 71.800
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.825
}
]
},
{
"resolution_limits": [54.010,9.110],
"number_observations_unique": 270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
}
]
}