Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "08fc668de97ddae2e949a81f5c1c8137",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 38.014,
"b": 43.232,
"c": 79.010,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95397],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.50,1.14],
"number_observations_unique": 48330,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "R(meas)",
"value": 0.138
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 6.4
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [39.50,6.24],
"number_observations_unique": 362,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "Redundancy",
"value": 5.8
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
{
"resolution_limits": [1.16,1.14],
"number_observations_unique": 2338,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.711
},
{
"type": "R(meas)",
"value": 2.215
},
{
"type": "R(pim)",
"value": 1.383
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.298
}
]
}
]
}