Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "673ab6336ef8a8f74b1f58dee7891fea",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.929,
"b": 101.249,
"c": 104.037,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [72.56,1.82],
"number_observations_unique": 45798,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.211
},
{
"type": "R(meas)",
"value": 0.220
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 8.2
},
{
"type": "Completeness",
"value": 94.6
},
{
"type": "Redundancy",
"value": 13.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.01,1.82],
"number_observations_unique": 2290,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.705
},
{
"type": "R(meas)",
"value": 2.803
},
{
"type": "R(pim)",
"value": 0.731
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 70.1
},
{
"type": "Redundancy",
"value": 14.6
},
{
"type": "CC(1/2)",
"value": 0.605
}
]
}
]
}