Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2df3314b2acf75f6222d54cb7f9c4ab1",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 179.902,
"b": 76.253,
"c": 106.429,
"alpha": 90.00,
"beta": 111.68,
"gamma": 90.00
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.42,2.23],
"number_observations_unique": 65482,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.174
},
{
"type": "R(meas)",
"value": 0.199
},
{
"type": "R(pim)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 2.23
},
{
"type": "Completeness",
"value": 99.84
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.267,2.23],
"number_observations_unique": 3278,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.297
},
{
"type": "R(meas)",
"value": 1.477
},
{
"type": "R(pim)",
"value": 0.698
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "CC(1/2)",
"value": 0.330
}
]
}
]
}