Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5f8fce50655b5a3f0e9aa2ce58cffc76",
"space_group_name": "P 1",
"unit_cell": {
"a": 24.470,
"b": 29.673,
"c": 33.259,
"alpha": 88.335,
"beta": 78.611,
"gamma": 76.921
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.6,1.55],
"number_observations_unique": 12546,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.151
},
{
"type": "R(pim)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 96.8
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.928
}
]
},
"refln_shells": [
{
"resolution_limits": [1.58,1.55],
"number_observations_unique": 607,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.521
},
{
"type": "R(meas)",
"value": 0.626
},
{
"type": "R(pim)",
"value": 0.343
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.832
}
]
}
]
}