Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "eff96024b052a77a3e88dbd0e2741e3b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 38.613,
"b": 68.289,
"c": 50.899,
"alpha": 90.000,
"beta": 105.759,
"gamma": 90.000
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.84,1.95],
"number_observations_unique": 18560,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.00,1.95],
"number_observations_unique": 1259,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.344
},
{
"type": "R(meas)",
"value": 0.480
},
{
"type": "R(pim)",
"value": 0.333
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.538
}
]
}
]
}