Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f0e541295a2f0fa3d4fc0f53defa3336",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 83.33,
"b": 203.53,
"c": 254.94,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.60,2.50],
"number_observations": 2047251,
"number_observations_unique": 150533,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.309
},
{
"type": "R(meas)",
"value": 0.321
},
{
"type": "R(pim)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 9.8
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.6
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.56,2.50],
"number_observations": 153541,
"number_observations_unique": 11001,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.992
},
{
"type": "R(meas)",
"value": 2.067
},
{
"type": "R(pim)",
"value": 0.550
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 14.0
},
{
"type": "CC(1/2)",
"value": 0.557
}
]
}
]
}