Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d78d385d6fa61ff33a00ca1e4b22e164",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 209.747,
"b": 113.236,
"c": 189.399,
"alpha": 90.00,
"beta": 90.62,
"gamma": 90.00
},
"wavelengths": [0.97624],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [104.867,2.182],
"number_observations": 1463474,
"number_observations_unique": 205160,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 12.1
},
{
"type": "Completeness",
"value": 95.2
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.303,2.182],
"number_observations": 76436,
"number_observations_unique": 10260,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.451
},
{
"type": "R(pim)",
"value": 0.569
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.562
}
]
},
{
"resolution_limits": [104.867,6.206],
"number_observations": 72493,
"number_observations_unique": 10256,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 38.8
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}