Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b28baeeb4d63ca9e66f60071738ecf19",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 102.806,
"b": 50.947,
"c": 153.150,
"alpha": 90.00,
"beta": 95.62,
"gamma": 90.00
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [152.41,1.64],
"number_observations": 1188075,
"number_observations_unique": 181573,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 13.3
},
{
"type": "Completeness",
"value": 93.6
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.68,1.64],
"number_observations": 96470,
"number_observations_unique": 14198,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.183
},
{
"type": "R(meas)",
"value": 1.281
},
{
"type": "R(pim)",
"value": 0.486
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.648
}
]
}
]
}