Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c793363dc1a79707c13306e233025873",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 99.017,
"b": 99.058,
"c": 128.419,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.03,1.91],
"number_observations": 672847,
"number_observations_unique": 49074,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.294
},
{
"type": "R(meas)",
"value": 0.305
},
{
"type": "R(pim)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 5.8
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.96,1.91],
"number_observations": 44340,
"number_observations_unique": 3108,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.773
},
{
"type": "R(meas)",
"value": 2.876
},
{
"type": "R(pim)",
"value": 0.758
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 14.3
},
{
"type": "CC(1/2)",
"value": 0.560
}
]
}
]
}