Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "707e416b25977d67cec55d9f50d8fd9d",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 64.523,
"b": 88.167,
"c": 98.031,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.985,1.285],
"number_observations_unique": 105707,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 20.7
},
{
"type": "Completeness",
"value": 95.71
},
{
"type": "Redundancy",
"value": 26
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.422,1.285],
"number_observations_unique": 5286,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.855
},
{
"type": "R(meas)",
"value": 2.908
},
{
"type": "R(pim)",
"value": 0.548
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 66.9
},
{
"type": "Redundancy",
"value": 27.7
},
{
"type": "CC(1/2)",
"value": 0.474
}
]
}
]
}