Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c8ca5b4eba2bce6a22f62bbbdb9a14eb",
"space_group_name": "P 61",
"unit_cell": {
"a": 91.276,
"b": 91.276,
"c": 383.567,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.37700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [77.450,2.04],
"number_observations_unique": 112407,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.3485
},
{
"type": "R(meas)",
"value": 0.3527
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 13.91
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 50.600
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [2.070,2.040],
"number_observations": 83081,
"number_observations_unique": 4848,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.169
},
{
"type": "R(meas)",
"value": 9.450
},
{
"type": "R(pim)",
"value": 2.241
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 84.700
},
{
"type": "Redundancy",
"value": 17.100
},
{
"type": "CC(1/2)",
"value": 0.379
}
]
},
{
"resolution_limits": [77.450,11.170],
"number_observations": 45930,
"number_observations_unique": 735,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 35.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 62.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}