Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ce8d45d7a5c27e9b813eaeff852c8c12",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.25,
"b": 61.41,
"c": 65.09,
"alpha": 90.00,
"beta": 92.83,
"gamma": 90.00
},
"wavelengths": [0.92201],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.40,1.41],
"number_observations": 330652,
"number_observations_unique": 54478,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.153
},
{
"type": "R(meas)",
"value": 0.167
},
{
"type": "R(pim)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 11.4
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.45,1.41],
"number_observations": 17540,
"number_observations_unique": 3902,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.327
},
{
"type": "R(meas)",
"value": 1.503
},
{
"type": "R(pim)",
"value": 0.695
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.370
}
]
}
]
}