Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f001cbaf49d73f6e6c7d3ae5abad33c7",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 74.780,
"b": 90.317,
"c": 82.924,
"alpha": 90.00,
"beta": 115.72,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [74.71,1.52],
"number_observations_unique": 151061,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 12.7
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.60,1.52],
"number_observations_unique": 21750,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.352
},
{
"type": "R(meas)",
"value": 0.454
},
{
"type": "R(pim)",
"value": 0.227
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 98.0
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.899
}
]
}
]
}