Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dec53bcc840b565997d63d0c8a912b3e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 127.020,
"b": 60.681,
"c": 131.258,
"alpha": 90.00,
"beta": 107.86,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [62.467,3.933],
"number_observations_unique": 8960,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.465
},
{
"type": "R(meas)",
"value": 0.511
},
{
"type": "R(pim)",
"value": 0.208
},
{
"type": "I/SigI",
"value": 6.4
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.865
}
]
},
"refln_shells": [
{
"resolution_limits": [4.001,3.933],
"number_observations_unique": 429,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.931
},
{
"type": "R(meas)",
"value": 1.090
},
{
"type": "R(pim)",
"value": 0.552
},
{
"type": "I/SigI",
"value": 3.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.511
}
]
}
]
}