Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d26ce70bf834497435a0d7192c17f4c4",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 46.790,
"b": 46.809,
"c": 137.596,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.81,1.6],
"number_observations_unique": 40092,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.131
},
{
"type": "R(meas)",
"value": 0.143
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 11.3
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 11.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [46.81,8.76],
"number_observations_unique": 305,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 22.7
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "Redundancy",
"value": 12.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [1.63,1.60],
"number_observations_unique": 1913,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.550
},
{
"type": "R(meas)",
"value": 0.597
},
{
"type": "R(pim)",
"value": 0.231
},
{
"type": "I/SigI",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.843
}
]
}
]
}