Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6f9d068ae37c123dc7223d2b76eb4f2f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.47,
"b": 52.73,
"c": 44.65,
"alpha": 90.00,
"beta": 103.01,
"gamma": 90.00
},
"wavelengths": [0.91267],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.52,1.62],
"number_observations": 107671,
"number_observations_unique": 32068,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "R(meas)",
"value": 0.140
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 6.4
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.66,1.62],
"number_observations": 6927,
"number_observations_unique": 2334,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.570
},
{
"type": "R(meas)",
"value": 1.928
},
{
"type": "R(pim)",
"value": 1.101
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.322
}
]
}
]
}