Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "0594317531d5277a60ceac4cdb7c492c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 56.249,
"b": 80.002,
"c": 57.692,
"alpha": 90.0,
"beta": 116.4,
"gamma": 90.0
},
"wavelengths": [0.97861],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.67,1.79],
"number_observations_unique": 42599,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.100
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 13.9
},
{
"type": "Completeness",
"value": 98.3
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.88,1.79],
"number_observations_unique": 5880,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.556
},
{
"type": "R(meas)",
"value": 0.649
},
{
"type": "R(pim)",
"value": 0.327
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "CC(1/2)",
"value": 0.693
}
]
}
]
}