Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "29dabf98072c5847304352a2848b03fc",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 206.748,
"b": 112.962,
"c": 187.947,
"alpha": 90.00,
"beta": 92.36,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [103.287,2.098],
"number_observations": 1891926,
"number_observations_unique": 171866,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 12.6
},
{
"type": "Completeness",
"value": 94.8
},
{
"type": "Redundancy",
"value": 11.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.276,2.098],
"number_observations": 95102,
"number_observations_unique": 8595,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.620
},
{
"type": "R(pim)",
"value": 0.510
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 0.638
}
]
},
{
"resolution_limits": [103.287,6.529],
"number_observations": 95718,
"number_observations_unique": 8591,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 37.1
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}