Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "92cfead5a0611fcd41f76931278caf73",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.269,
"b": 41.295,
"c": 71.903,
"alpha": 90.0,
"beta": 104.4,
"gamma": 90.0
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.94,1.42],
"number_observations": 311891,
"number_observations_unique": 43783,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 23.0
},
{
"type": "Completeness",
"value": 96.4
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.50,1.42],
"number_observations": 44788,
"number_observations_unique": 6249,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.376
},
{
"type": "R(meas)",
"value": 0.428
},
{
"type": "R(pim)",
"value": 0.158
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.949
}
]
}
]
}