Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "586a5f8b588dc201f3aea259f1dcc8c8",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.782,
"b": 61.395,
"c": 65.507,
"alpha": 90.00,
"beta": 92.94,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.53,1.36],
"number_observations": 371171,
"number_observations_unique": 59294,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "R(meas)",
"value": 0.107
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 6.6
},
{
"type": "Completeness",
"value": 95.8
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.38,1.36],
"number_observations": 9232,
"number_observations_unique": 2221,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.073
},
{
"type": "R(meas)",
"value": 2.375
},
{
"type": "R(pim)",
"value": 1.126
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.301
}
]
}
]
}