Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b84bfe07e94fe29425dee08a0b2bbee6",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 113.754,
"b": 185.055,
"c": 93.734,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.61990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.23,3.16],
"number_observations": 45988,
"number_observations_unique": 15746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.194
},
{
"type": "R(meas)",
"value": 0.235
},
{
"type": "R(pim)",
"value": 0.130
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 90.5
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.939
}
]
},
"refln_shells": [
{
"resolution_limits": [3.21,3.16],
"number_observations": 2293,
"number_observations_unique": 788,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.720
},
{
"type": "R(meas)",
"value": 0.875
},
{
"type": "R(pim)",
"value": 0.491
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.530
}
]
}
]
}