Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bcd4790b7c9a692b3b458cd46cbc9162",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 57.61,
"b": 42.81,
"c": 76.70,
"alpha": 90.00,
"beta": 108.44,
"gamma": 90.00
},
"wavelengths": [0.97800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.53,1.26],
"number_observations_unique": 93487,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 13.6
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 11.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.29,1.26],
"number_observations_unique": 6513,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.467
},
{
"type": "R(pim)",
"value": 0.583
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 92.4
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.557
}
]
}
]
}