Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9e4df3abdbc3a2b9667a02e42dbd9a01",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 227.82,
"b": 39.50,
"c": 74.98,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.35,1.90],
"number_observations_unique": 41762,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 76.4
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.93,1.90],
"number_observations_unique": 2100,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.373
},
{
"type": "R(meas)",
"value": 1.777
},
{
"type": "R(pim)",
"value": 1.112
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Completeness",
"value": 78.2
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.282
}
]
}
]
}