Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "52bcd36599a350c90aa8a81bc6cc9f9a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 78.185,
"b": 91.366,
"c": 124.316,
"alpha": 90.000,
"beta": 94.705,
"gamma": 90.000
},
"wavelengths": [1.54190],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [80.0,2.48],
"number_observations_unique": 81074,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.292
},
{
"type": "R(meas)",
"value": 0.327
},
{
"type": "R(pim)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 7.1
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 9.6
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
},
"refln_shells": [
{
"resolution_limits": [2.52,2.48],
"number_observations_unique": 4362,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.02
},
{
"type": "R(meas)",
"value": 1.30
},
{
"type": "R(pim)",
"value": 0.623
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 96.2
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.18
}
]
}
]
}