Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0e5b2bad0b1fc5b28f59af665dacc32b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.609,
"b": 61.747,
"c": 65.237,
"alpha": 90.00,
"beta": 93.01,
"gamma": 90.00
},
"wavelengths": [0.92201],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.56,1.15],
"number_observations": 409962,
"number_observations_unique": 77695,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 13.1
},
{
"type": "Completeness",
"value": 76.3
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.15],
"number_observations": 304,
"number_observations_unique": 303,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.996
},
{
"type": "R(meas)",
"value": 1.524
},
{
"type": "R(pim)",
"value": 0.974
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.292
}
]
}
]
}