Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e1fc12df91ee3275adcccce1e0b5af3b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 41.352,
"b": 74.365,
"c": 101.402,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97628],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.70,1.38],
"number_observations": 867044,
"number_observations_unique": 65197,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.167
},
{
"type": "R(meas)",
"value": 0.174
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.40,1.38],
"number_observations": 43015,
"number_observations_unique": 3269,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.112
},
{
"type": "R(meas)",
"value": 3.239
},
{
"type": "R(pim)",
"value": 0.892
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Redundancy",
"value": 13.2
},
{
"type": "CC(1/2)",
"value": 0.652
}
]
}
]
}