Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "acf9ab08d9ff0076f0a64b746b64aee8",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.734,
"b": 88.734,
"c": 39.507,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.370,0.980],
"number_observations": 1088416,
"number_observations_unique": 175015,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 17.700
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.000,0.980],
"number_observations": 29068,
"number_observations_unique": 7831,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.171
},
{
"type": "R(meas)",
"value": 1.361
},
{
"type": "R(pim)",
"value": 0.676
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 90.400
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.533
}
]
},
{
"resolution_limits": [44.370,5.370],
"number_observations": 8049,
"number_observations_unique": 1165,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 68.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}