Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "9817548d78963a0f2f0e840ba69520f1",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 59.855,
"b": 56.641,
"c": 80.397,
"alpha": 90.00,
"beta": 103.94,
"gamma": 90.00
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.03,2.94],
"number_observations": 57882,
"number_observations_unique": 11324,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.166
},
{
"type": "R(meas)",
"value": 0.185
},
{
"type": "R(pim)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 7.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [3.02,2.94],
"number_observations": 4463,
"number_observations_unique": 827,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.043
},
{
"type": "R(meas)",
"value": 1.153
},
{
"type": "R(pim)",
"value": 0.483
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.724
}
]
}
]
}