Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "396ee28dbf86ab64963d560fa3696cec",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.439,
"b": 95.439,
"c": 45.914,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.470,1.340],
"number_observations": 546293,
"number_observations_unique": 46517,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 15.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.360,1.340],
"number_observations": 11899,
"number_observations_unique": 2269,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.652
},
{
"type": "R(meas)",
"value": 1.847
},
{
"type": "R(pim)",
"value": 0.794
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.298
}
]
},
{
"resolution_limits": [67.470,7.340],
"number_observations": 3804,
"number_observations_unique": 313,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 90.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}