Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3a44394ccd0629c7165e09fc95980f0a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 43.423,
"b": 67.214,
"c": 68.361,
"alpha": 90.000,
"beta": 96.746,
"gamma": 90.000
},
"wavelengths": [1.00002],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.76,4],
"number_observations_unique": 3361,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 11.5
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [4.47,4],
"number_observations_unique": 941,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "I/SigI",
"value": 6.5
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
}
]
}