Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "567a21c926ed4b28c9cce27bb3128b02",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.555,
"b": 95.555,
"c": 45.879,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.550,1.280],
"number_observations": 573384,
"number_observations_unique": 52832,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 14.800
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 10.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.300,1.280],
"number_observations": 7537,
"number_observations_unique": 2277,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.203
},
{
"type": "R(meas)",
"value": 1.439
},
{
"type": "R(pim)",
"value": 0.759
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 87.100
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.291
}
]
},
{
"resolution_limits": [67.550,7.010],
"number_observations": 4392,
"number_observations_unique": 357,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 85.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
}
]
}