Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e911d3e1455de1923d627cdcd7a11924",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 153.49,
"b": 59.40,
"c": 147.65,
"alpha": 90.0,
"beta": 120.3,
"gamma": 90.0
},
"wavelengths": [0.96860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [63.740,1.760],
"number_observations": 234810,
"number_observations_unique": 97480,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.118
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 85.700
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
"refln_shells": [
{
"resolution_limits": [1.810,1.760],
"number_observations_unique": 7437,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.788
},
{
"type": "R(meas)",
"value": 1.003
},
{
"type": "R(pim)",
"value": 0.611
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 88.600
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.454
}
]
},
{
"resolution_limits": [63.740,7.870],
"number_observations_unique": 1003,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "Completeness",
"value": 73.900
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.965
}
]
}
]
}