Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fb22bb84f56ff7e5d104fb2dcd4f5ac5",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 73.323,
"b": 114.959,
"c": 120.918,
"alpha": 90.00,
"beta": 100.79,
"gamma": 90.00
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [82.74,2.270],
"number_observations_unique": 91197,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "R(meas)",
"value": 0.131
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 4.700
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.390,2.270],
"number_observations_unique": 13367,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.393
},
{
"type": "R(meas)",
"value": 1.648
},
{
"type": "R(pim)",
"value": 0.873
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.616
}
]
},
{
"resolution_limits": [82.610,7.160],
"number_observations_unique": 2948,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}