Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "201b6256f8cad6c6a70d39a8b13c8f39",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 59.641,
"b": 103.230,
"c": 84.495,
"alpha": 90.00,
"beta": 110.42,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [79.19,1.95],
"number_observations_unique": 33360,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.143
},
{
"type": "R(meas)",
"value": 0.155
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 95.5
},
{
"type": "Redundancy",
"value": 12.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.00,1.95],
"number_observations_unique": 1742,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.795
},
{
"type": "R(meas)",
"value": 2.047
},
{
"type": "R(pim)",
"value": 0.954
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 69.9
},
{
"type": "Redundancy",
"value": 8.2
},
{
"type": "CC(1/2)",
"value": 0.497
}
]
}
]
}