Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "666137fdaa7b86b108d41353b610a73f",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 70.955,
"b": 70.955,
"c": 196.386,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.730,1.990],
"number_observations": 786585,
"number_observations_unique": 35690,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.822
},
{
"type": "R(meas)",
"value": 0.841
},
{
"type": "R(pim)",
"value": 0.176
},
{
"type": "I/SigI",
"value": 6.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.000
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.090,1.990],
"number_observations": 118025,
"number_observations_unique": 5092,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.536
},
{
"type": "R(meas)",
"value": 7.701
},
{
"type": "R(pim)",
"value": 1.577
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 23.200
},
{
"type": "CC(1/2)",
"value": 0.515
}
]
},
{
"resolution_limits": [66.730,6.280],
"number_observations": 24437,
"number_observations_unique": 1320,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.094
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 23.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 18.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}