Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "4f51bc51dbbe890108582798c52b3e06",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 68.584,
"b": 67.632,
"c": 79.533,
"alpha": 90.00,
"beta": 99.83,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.14,2.04],
"number_observations": 320897,
"number_observations_unique": 45711,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.172
},
{
"type": "R(meas)",
"value": 0.186
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 8.2
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.04],
"number_observations": 14914,
"number_observations_unique": 2213,
"quality_factors": [
{
"type": "R(merge)",
"value": 6.630
},
{
"type": "R(meas)",
"value": 7.195
},
{
"type": "R(pim)",
"value": 2.768
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.338
}
]
}
]
}