Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "952ba036bf6167b7c8fde1910a1f26a1",
"space_group_name": "P 63",
"unit_cell": {
"a": 101.884,
"b": 101.884,
"c": 146.250,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.750,1.590],
"number_observations": 1174206,
"number_observations_unique": 115112,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 19.600
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.640,1.590],
"number_observations": 113526,
"number_observations_unique": 11130,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.507
},
{
"type": "I/SigI",
"value": 3.800
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.921
}
]
},
{
"resolution_limits": [48.750,6.150],
"number_observations": 20298,
"number_observations_unique": 2050,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 48.400
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 9.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}