Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d8a7659a27ee48aad5bf4325ddbc42dd",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 49.725,
"b": 58.952,
"c": 57.733,
"alpha": 90.00,
"beta": 99.41,
"gamma": 90.00
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.53,1.75],
"number_observations_unique": 33094,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.124
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 11.7
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.75],
"number_observations_unique": 1827,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.085
},
{
"type": "R(pim)",
"value": 0.667
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.342
}
]
}
]
}