Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f0dbf3a9147a93b3694ff9c0607a98a8",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 80.35,
"b": 182.57,
"c": 242.16,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97915],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.54,1.8100],
"number_observations_unique": 161417,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "R(meas)",
"value": 0.148
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 10.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.8600,1.8100],
"number_observations_unique": 11837,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.229
},
{
"type": "R(meas)",
"value": 1.325
},
{
"type": "R(pim)",
"value": 0.495
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 14.0
},
{
"type": "CC(1/2)",
"value": 0.794
}
]
}
]
}