Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4de67aadee5d47eaa2cc471162fb7673",
"space_group_name": "P 1",
"unit_cell": {
"a": 100.757,
"b": 102.628,
"c": 103.114,
"alpha": 90.72,
"beta": 117.39,
"gamma": 119.37
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.690,2.600],
"number_observations_unique": 91259,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.122
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 7.700
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.650,2.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.153
},
{
"type": "R(meas)",
"value": 1.367
},
{
"type": "R(pim)",
"value": 0.726
},
{
"type": "Completeness",
"value": 93.800
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.331
}
]
},
{
"resolution_limits": [45.690,14.250],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "Completeness",
"value": 94.800
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}