Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "339b6dfb1f528ad28d02006c7ee1bfde",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 79.640,
"b": 191.914,
"c": 151.920,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97690],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.210,2.600],
"number_observations": 99819,
"number_observations_unique": 34681,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 6.800
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.710,2.600],
"number_observations": 11988,
"number_observations_unique": 4144,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.478
},
{
"type": "R(pim)",
"value": 0.326
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.710
}
]
},
{
"resolution_limits": [66.210,9.000],
"number_observations": 2571,
"number_observations_unique": 865,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 13.600
},
{
"type": "Completeness",
"value": 91.800
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}