Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b75e6d90fa22b123b8058094e0c9d1a9",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.280,
"b": 61.543,
"c": 59.987,
"alpha": 90.00,
"beta": 97.73,
"gamma": 90.00
},
"wavelengths": [1.58700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.76,2.068],
"number_observations_unique": 18740,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1887
},
{
"type": "R(meas)",
"value": 0.203
},
{
"type": "I/SigI",
"value": 9.46
},
{
"type": "Completeness",
"value": 99.81
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [2.141,2.068],
"number_observations_unique": 1832,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.3291
},
{
"type": "I/SigI",
"value": 4.79
},
{
"type": "Completeness",
"value": 98.07
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.913
}
]
}
]
}