Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "90a501d384617c7a70ba5f34b99f76f8",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 86.65,
"b": 86.65,
"c": 147.73,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [74.74,2.100],
"number_observations": 503994,
"number_observations_unique": 33489,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 16.000
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 15.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.170,2.100],
"number_observations": 26630,
"number_observations_unique": 2923,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.092
},
{
"type": "R(pim)",
"value": 0.369
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 9.100
},
{
"type": "CC(1/2)",
"value": 0.501
}
]
},
{
"resolution_limits": [61.270,8.400],
"number_observations": 7417,
"number_observations_unique": 579,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 40.400
},
{
"type": "Completeness",
"value": 92.400
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}