Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f49fd30a3b4e469b0a32b9bb1415e7c5",
"space_group_name": "P 1",
"unit_cell": {
"a": 32.846,
"b": 54.090,
"c": 83.729,
"alpha": 105.05,
"beta": 90.00,
"gamma": 107.67
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [80.56,2.18],
"number_observations_unique": 26506,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.134
},
{
"type": "R(meas)",
"value": 0.156
},
{
"type": "R(pim)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 11.6
},
{
"type": "Completeness",
"value": 96.6
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.973
}
]
},
"refln_shells": [
{
"resolution_limits": [2.25,2.18],
"number_observations_unique": 1800,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.394
},
{
"type": "R(meas)",
"value": 0.548
},
{
"type": "R(pim)",
"value": 0.379
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 76.5
},
{
"type": "Redundancy",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.552
}
]
}
]
}