Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "53c0e4c7432d1f4d9b17da20262df147",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 86.789,
"b": 159.060,
"c": 189.316,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [76.186,2.747],
"number_observations_unique": 51577,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 12.7
},
{
"type": "Completeness",
"value": 74.6
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.862,2.747],
"number_observations_unique": 2580,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.957
},
{
"type": "R(meas)",
"value": 1.053
},
{
"type": "R(pim)",
"value": 0.433
},
{
"type": "I/SigI",
"value": 33.0
},
{
"type": "Completeness",
"value": 33.0
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.776
}
]
}
]
}