Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "1958c943577b987cdd8b26ee1967c752",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 88.633,
"b": 122.330,
"c": 88.974,
"alpha": 90.00,
"beta": 105.67,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.17,1.58],
"number_observations": 1325365,
"number_observations_unique": 244025,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 13.9
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.67,1.58],
"number_observations": 187057,
"number_observations_unique": 35068,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.602
},
{
"type": "R(meas)",
"value": 0.667
},
{
"type": "R(pim)",
"value": 0.284
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.873
}
]
}
]
}