Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "90df0456f30edc3075bdfb0fbb9c8c08",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.706,
"b": 88.706,
"c": 39.498,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.350,0.990],
"number_observations": 1101041,
"number_observations_unique": 169728,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 17.300
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 38232,
"number_observations_unique": 7682,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.679
},
{
"type": "R(meas)",
"value": 2.995
},
{
"type": "R(pim)",
"value": 1.309
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 91.100
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.376
}
]
},
{
"resolution_limits": [44.350,5.420],
"number_observations": 7873,
"number_observations_unique": 1133,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 85.200
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}