Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bfbf3da88603ab0b1e8ea9d849b8820b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 38.853,
"b": 46.881,
"c": 71.758,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88560],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.250,1.450],
"number_observations": 189240,
"number_observations_unique": 23842,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 13.100
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 7.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.470,1.450],
"number_observations": 3339,
"number_observations_unique": 999,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.627
},
{
"type": "R(meas)",
"value": 1.907
},
{
"type": "R(pim)",
"value": 0.966
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 86.200
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.288
}
]
},
{
"resolution_limits": [39.250,7.930],
"number_observations": 1353,
"number_observations_unique": 185,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 42.700
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 7.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}