Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d43a310ae6082bd0602907576238052d",
"space_group_name": "P 1",
"unit_cell": {
"a": 59.112,
"b": 70.206,
"c": 85.095,
"alpha": 102.61,
"beta": 95.93,
"gamma": 112.44
},
"wavelengths": [0.91260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.210,2.210],
"number_observations": 204401,
"number_observations_unique": 59129,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.145
},
{
"type": "R(pim)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 5.700
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.210],
"number_observations": 16032,
"number_observations_unique": 4619,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.290
},
{
"type": "R(meas)",
"value": 1.531
},
{
"type": "R(pim)",
"value": 0.812
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.354
}
]
},
{
"resolution_limits": [81.210,9.620],
"number_observations": 2740,
"number_observations_unique": 723,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 25.600
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}